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Imidazoles

Aromatic organic heterocyclic compounds that consist of a diazole with non-adjacent nitrogen atoms with the formula: C3N2H4.
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1 – 15 of 156 results
1

1-Methylimidazole, 99%

CAS: 616-47-7 Molecular Formula: C4H6N2 Molecular Weight (g/mol): 82.11 MDL Number: MFCD00005292 InChI Key: MCTWTZJPVLRJOU-UHFFFAOYSA-N Synonym: 1-methyl-1h-imidazole,n-methylimidazole,1h-imidazole, 1-methyl,imidazole, 1-methyl,n-methyl imidazole,1-methyl-imidazole,unii-p4617qs63y,1-methyl-1h-imidazol,n-methylimidazol,1-methylimdazole PubChem CID: 1390 ChEBI: CHEBI:113454 SMILES: CN1C=CN=C1

PubChem CID 1390
CAS 616-47-7
Molecular Weight (g/mol) 82.11
ChEBI CHEBI:113454
MDL Number MFCD00005292
SMILES CN1C=CN=C1
Synonym 1-methyl-1h-imidazole,n-methylimidazole,1h-imidazole, 1-methyl,imidazole, 1-methyl,n-methyl imidazole,1-methyl-imidazole,unii-p4617qs63y,1-methyl-1h-imidazol,n-methylimidazol,1-methylimdazole
InChI Key MCTWTZJPVLRJOU-UHFFFAOYSA-N
Molecular Formula C4H6N2
2

1-Vinylimidazole, 99%

CAS: 1072-63-5 Molecular Formula: C5H6N2 Molecular Weight (g/mol): 94.12 MDL Number: MFCD00005297 InChI Key: OSSNTDFYBPYIEC-UHFFFAOYSA-N Synonym: 1-vinylimidazole,1-vinyl-1h-imidazole,n-vinylimidazole,1h-imidazole, 1-ethenyl,lufixan,polyvinylimidazole,poly vinylimidazole,poly n-vinylimidazole,poly 1-vinylimidazole,n-vinylimidazole polymer PubChem CID: 66171 SMILES: C=CN1C=CN=C1

PubChem CID 66171
CAS 1072-63-5
Molecular Weight (g/mol) 94.12
MDL Number MFCD00005297
SMILES C=CN1C=CN=C1
Synonym 1-vinylimidazole,1-vinyl-1h-imidazole,n-vinylimidazole,1h-imidazole, 1-ethenyl,lufixan,polyvinylimidazole,poly vinylimidazole,poly n-vinylimidazole,poly 1-vinylimidazole,n-vinylimidazole polymer
InChI Key OSSNTDFYBPYIEC-UHFFFAOYSA-N
Molecular Formula C5H6N2
3

1,1'-Carbonyldiimidazole, 97%

CAS: 530-62-1 Molecular Formula: C7H6N4O Molecular Weight (g/mol): 162.15 MDL Number: MFCD00005286 InChI Key: PFKFTWBEEFSNDU-UHFFFAOYSA-N Synonym: 1,1'-carbonyldiimidazole,n,n'-carbonyldiimidazole,carbonyldiimidazole,di 1h-imidazol-1-yl methanone,n,n-carbonyldiimidazole,1h-imidazole, 1,1'-carbonylbis,1,1'-carbonylbis-1h-imidazole,carbonyl diimidazole,diimidazol-1-yl ketone,1,1-carbonyldiimidazole PubChem CID: 68263 SMILES: O=C(N1C=CN=C1)N1C=CN=C1

PubChem CID 68263
CAS 530-62-1
Molecular Weight (g/mol) 162.15
MDL Number MFCD00005286
SMILES O=C(N1C=CN=C1)N1C=CN=C1
Synonym 1,1'-carbonyldiimidazole,n,n'-carbonyldiimidazole,carbonyldiimidazole,di 1h-imidazol-1-yl methanone,n,n-carbonyldiimidazole,1h-imidazole, 1,1'-carbonylbis,1,1'-carbonylbis-1h-imidazole,carbonyl diimidazole,diimidazol-1-yl ketone,1,1-carbonyldiimidazole
InChI Key PFKFTWBEEFSNDU-UHFFFAOYSA-N
Molecular Formula C7H6N4O
4

1-(3-Aminopropyl)imidazole, 98%

CAS: 5036-48-6 Molecular Formula: C6H11N3 Molecular Weight (g/mol): 125.18 MDL Number: MFCD00009819 InChI Key: KDHWOCLBMVSZPG-UHFFFAOYSA-N Synonym: 1-3-aminopropyl imidazole,n-3-aminopropyl imidazole,1h-imidazole-1-propanamine,n-3-aminopropyl-imidazole,3-1h-imidazol-1-yl propan-1-amine,3-imidazol-1-ylpropylamine,3-1h-imidazol-1-yl-1-propanamine,1-3-aminopropyl-imidazole,3-imidazol-1-yl propylamine,3-imidazolylpropylamine PubChem CID: 78736 SMILES: NCCCN1C=CN=C1

PubChem CID 78736
CAS 5036-48-6
Molecular Weight (g/mol) 125.18
MDL Number MFCD00009819
SMILES NCCCN1C=CN=C1
Synonym 1-3-aminopropyl imidazole,n-3-aminopropyl imidazole,1h-imidazole-1-propanamine,n-3-aminopropyl-imidazole,3-1h-imidazol-1-yl propan-1-amine,3-imidazol-1-ylpropylamine,3-1h-imidazol-1-yl-1-propanamine,1-3-aminopropyl-imidazole,3-imidazol-1-yl propylamine,3-imidazolylpropylamine
InChI Key KDHWOCLBMVSZPG-UHFFFAOYSA-N
Molecular Formula C6H11N3
5

1-Ethyl-3-methylimidazolium acetate, 97%

CAS: 143314-17-4 Molecular Formula: C8H14N2O2 Molecular Weight (g/mol): 170.212 MDL Number: MFCD06798186 InChI Key: XIYUIMLQTKODPS-UHFFFAOYSA-M Synonym: 1-ethyl-3-methylimidazolium acetate,basionic tm bc 01,emim ac,1-ethyl-3-methylimidazoliumacetate,basionics™ bc 01,acmc-1c26d,1h-imidazolium, 3-ethyl-1-methyl-, acetate 1:1,1-methyl-3-ethylimidazolium acetate,1-ethyl-3-methylimidazolium acetate hplc PubChem CID: 11658353 IUPAC Name: 1-ethyl-3-methylimidazol-3-ium;acetate SMILES: CCN1C=C[N+](=C1)C.CC(=O)[O-]

PubChem CID 11658353
CAS 143314-17-4
Molecular Weight (g/mol) 170.212
MDL Number MFCD06798186
SMILES CCN1C=C[N+](=C1)C.CC(=O)[O-]
Synonym 1-ethyl-3-methylimidazolium acetate,basionic tm bc 01,emim ac,1-ethyl-3-methylimidazoliumacetate,basionics™ bc 01,acmc-1c26d,1h-imidazolium, 3-ethyl-1-methyl-, acetate 1:1,1-methyl-3-ethylimidazolium acetate,1-ethyl-3-methylimidazolium acetate hplc
IUPAC Name 1-ethyl-3-methylimidazol-3-ium;acetate
InChI Key XIYUIMLQTKODPS-UHFFFAOYSA-M
Molecular Formula C8H14N2O2
6

1-Ethyl-3-methylimidazolium bromide, 98+%

CAS: 65039-08-9 Molecular Formula: C6H11BrN2 Molecular Weight (g/mol): 191.07 MDL Number: MFCD03427610 InChI Key: GWQYPLXGJIXMMV-UHFFFAOYSA-M Synonym: 1-ethyl-3-methylimidazolium bromide,3-ethyl-1-methyl-1h-imidazol-3-ium bromide,1-ethyl-3-methylmidazolium bromide,unii-xo254ye73i,1-ethyl-3-methyl-1h-imidazol-3-ium bromide,acmc-1b3a0,dsstox_cid_29300,dsstox_rid_83418,dsstox_gsid_49343,c6h11n2.br PubChem CID: 2734235 IUPAC Name: 1-ethyl-3-methylimidazol-3-ium;bromide SMILES: [Br-].CCN1C=C[N+](C)=C1

PubChem CID 2734235
CAS 65039-08-9
Molecular Weight (g/mol) 191.07
MDL Number MFCD03427610
SMILES [Br-].CCN1C=C[N+](C)=C1
Synonym 1-ethyl-3-methylimidazolium bromide,3-ethyl-1-methyl-1h-imidazol-3-ium bromide,1-ethyl-3-methylmidazolium bromide,unii-xo254ye73i,1-ethyl-3-methyl-1h-imidazol-3-ium bromide,acmc-1b3a0,dsstox_cid_29300,dsstox_rid_83418,dsstox_gsid_49343,c6h11n2.br
IUPAC Name 1-ethyl-3-methylimidazol-3-ium;bromide
InChI Key GWQYPLXGJIXMMV-UHFFFAOYSA-M
Molecular Formula C6H11BrN2
7

1,2-Dimethylimidazole, 98%

CAS: 1739-84-0 Molecular Formula: C5H8N2 Molecular Weight (g/mol): 96.13 MDL Number: MFCD00005294 InChI Key: GIWQSPITLQVMSG-UHFFFAOYSA-N Synonym: 1,2-dimethyl-1h-imidazole,1h-imidazole, 1,2-dimethyl,imidazole, 1,2-dimethyl,1h-imidazole, dimethyl,unii-q41bc3grjb,q41bc3grjb,lupragen r dmi,1,2-dimethylimdazole,1,2 dimethylimidazole,n,2-dimethylimidazole PubChem CID: 15617 IUPAC Name: 1,2-dimethylimidazole SMILES: CN1C=CN=C1C

PubChem CID 15617
CAS 1739-84-0
Molecular Weight (g/mol) 96.13
MDL Number MFCD00005294
SMILES CN1C=CN=C1C
Synonym 1,2-dimethyl-1h-imidazole,1h-imidazole, 1,2-dimethyl,imidazole, 1,2-dimethyl,1h-imidazole, dimethyl,unii-q41bc3grjb,q41bc3grjb,lupragen r dmi,1,2-dimethylimdazole,1,2 dimethylimidazole,n,2-dimethylimidazole
IUPAC Name 1,2-dimethylimidazole
InChI Key GIWQSPITLQVMSG-UHFFFAOYSA-N
Molecular Formula C5H8N2
8

4,5-Imidazoledicarboxylic acid, 97%

CAS: 570-22-9 Molecular Formula: C5H4N2O4 Molecular Weight (g/mol): 156.10 MDL Number: MFCD00005200 InChI Key: ZEVWQFWTGHFIDH-UHFFFAOYSA-N Synonym: 4,5-imidazoledicarboxylic acid,imidazole-4,5-dicarboxylic acid,glyoxalinedicarboxylic acid,4,5-dicarboxyimidazole,4,5-imidazoledicarboxylate,glycoxalinedicarboxylic acid,alpha-beta-imidazolecarboxylic acid,alpha,beta-imidazoledicarboxylic acid,4.5-imidazoledicarboxylic acid,4,5-imidazole dicarboxylic acid PubChem CID: 68442 IUPAC Name: 1H-imidazole-4,5-dicarboxylic acid SMILES: OC(=O)C1=C(N=CN1)C(O)=O

PubChem CID 68442
CAS 570-22-9
Molecular Weight (g/mol) 156.10
MDL Number MFCD00005200
SMILES OC(=O)C1=C(N=CN1)C(O)=O
Synonym 4,5-imidazoledicarboxylic acid,imidazole-4,5-dicarboxylic acid,glyoxalinedicarboxylic acid,4,5-dicarboxyimidazole,4,5-imidazoledicarboxylate,glycoxalinedicarboxylic acid,alpha-beta-imidazolecarboxylic acid,alpha,beta-imidazoledicarboxylic acid,4.5-imidazoledicarboxylic acid,4,5-imidazole dicarboxylic acid
IUPAC Name 1H-imidazole-4,5-dicarboxylic acid
InChI Key ZEVWQFWTGHFIDH-UHFFFAOYSA-N
Molecular Formula C5H4N2O4
9

1-Methyl-3-n-octylimidazolium chloride, 97%

CAS: 64697-40-1 Molecular Formula: C12H23ClN2 Molecular Weight (g/mol): 230.78 MDL Number: MFCD03095432 InChI Key: OXFBEEDAZHXDHB-UHFFFAOYSA-M Synonym: 1-methyl-3-n-octylimidazolium chloride,1-methyl-3-octylimidazolium chloride,1-octyl-3-methylimidazolium chloride,3-methyl-1-octylimidazolium chloride,omimcl,acmc-20aj1j,dsstox_cid_27849,dsstox_rid_82602,dsstox_gsid_47873,ksc491c7j PubChem CID: 2734223 ChEBI: CHEBI:61342 IUPAC Name: 1-methyl-3-octylimidazol-1-ium;chloride SMILES: [Cl-].CCCCCCCCN1C=C[N+](C)=C1

PubChem CID 2734223
CAS 64697-40-1
Molecular Weight (g/mol) 230.78
ChEBI CHEBI:61342
MDL Number MFCD03095432
SMILES [Cl-].CCCCCCCCN1C=C[N+](C)=C1
Synonym 1-methyl-3-n-octylimidazolium chloride,1-methyl-3-octylimidazolium chloride,1-octyl-3-methylimidazolium chloride,3-methyl-1-octylimidazolium chloride,omimcl,acmc-20aj1j,dsstox_cid_27849,dsstox_rid_82602,dsstox_gsid_47873,ksc491c7j
IUPAC Name 1-methyl-3-octylimidazol-1-ium;chloride
InChI Key OXFBEEDAZHXDHB-UHFFFAOYSA-M
Molecular Formula C12H23ClN2
10

Methyl imidazole-4-carboxylate, 98%

CAS: 17325-26-7 Molecular Formula: C5H6N2O2 Molecular Weight (g/mol): 126.12 MDL Number: MFCD00216584 InChI Key: DVLGIQNHKLWSRU-UHFFFAOYSA-N Synonym: methyl 4-imidazolecarboxylate,methyl 1h-imidazole-4-carboxylate,methyl imidazole-4-carboxylate,1h-imidazole-4-carboxylic acid, methyl ester,1h-imidazole-5-carboxylic acid methyl ester,methyl-4-imidazolecarboxylate,1h-imidazole-4-carboxylic acid methyl ester,methyl 3h-imidazole-4-carboxylate,imidazole-4-carboxylic acid, methyl ester,zlchem 863 PubChem CID: 565661 IUPAC Name: methyl 1H-imidazole-5-carboxylate SMILES: COC(=O)C1=CN=CN1

PubChem CID 565661
CAS 17325-26-7
Molecular Weight (g/mol) 126.12
MDL Number MFCD00216584
SMILES COC(=O)C1=CN=CN1
Synonym methyl 4-imidazolecarboxylate,methyl 1h-imidazole-4-carboxylate,methyl imidazole-4-carboxylate,1h-imidazole-4-carboxylic acid, methyl ester,1h-imidazole-5-carboxylic acid methyl ester,methyl-4-imidazolecarboxylate,1h-imidazole-4-carboxylic acid methyl ester,methyl 3h-imidazole-4-carboxylate,imidazole-4-carboxylic acid, methyl ester,zlchem 863
IUPAC Name methyl 1H-imidazole-5-carboxylate
InChI Key DVLGIQNHKLWSRU-UHFFFAOYSA-N
Molecular Formula C5H6N2O2
11

1-(Trifluoroacetyl)imidazole, 98+%

CAS: 1546-79-8 Molecular Formula: C5H3F3N2O Molecular Weight (g/mol): 164.087 MDL Number: MFCD00014501 InChI Key: SINBGNJPYWNUQI-UHFFFAOYSA-N Synonym: 1-trifluoroacetyl imidazole,n-trifluoroacetylimidazole,1-trifluoroacetyl-1h-imidazole,1h-imidazole, 1-trifluoroacetyl,unii-8c6041ow3i,tfai,2,2,2-trifluoro-1-1h-imidazol-1-yl ethanone,n-trifluoroacetyl imidazole,2,2,2-trifluoro-1-imidazol-1-yl ethanone,2,2,2-trifluoro-1-1h-imidazol-1-yl ethan-1-one PubChem CID: 73767 IUPAC Name: 2,2,2-trifluoro-1-imidazol-1-ylethanone SMILES: C1=CN(C=N1)C(=O)C(F)(F)F

PubChem CID 73767
CAS 1546-79-8
Molecular Weight (g/mol) 164.087
MDL Number MFCD00014501
SMILES C1=CN(C=N1)C(=O)C(F)(F)F
Synonym 1-trifluoroacetyl imidazole,n-trifluoroacetylimidazole,1-trifluoroacetyl-1h-imidazole,1h-imidazole, 1-trifluoroacetyl,unii-8c6041ow3i,tfai,2,2,2-trifluoro-1-1h-imidazol-1-yl ethanone,n-trifluoroacetyl imidazole,2,2,2-trifluoro-1-imidazol-1-yl ethanone,2,2,2-trifluoro-1-1h-imidazol-1-yl ethan-1-one
IUPAC Name 2,2,2-trifluoro-1-imidazol-1-ylethanone
InChI Key SINBGNJPYWNUQI-UHFFFAOYSA-N
Molecular Formula C5H3F3N2O
12

1-n-Butyl-3-methylimidazolium methyl sulfate, 99%

CAS: 401788-98-5 Molecular Formula: C9H18N2O4S Molecular Weight (g/mol): 250.31 MDL Number: MFCD03095437 InChI Key: MEMNKNZDROKJHP-UHFFFAOYSA-M Synonym: 1-butyl-3-methylimidazolium methyl sulfate,1-butyl-3-methylimidazolium methylsulfate,bmimmeso4,1-n-butyl-3-methylimidazolium methylsulfate,1-butyl-3-methylimidazolium methyl sulfate 1-,acmc-20aowh,basionics™ lq 02,1-butyl-3-methylimidazolium methylsul-fate,1-butyl-3-methylimidazol-3-ium,methyl sulfate,1-butyl-3-methyl-imidazol-3-ium; methyl sulfate PubChem CID: 12095228 SMILES: COS([O-])(=O)=O.CCCCN1C=C[N+](C)=C1

PubChem CID 12095228
CAS 401788-98-5
Molecular Weight (g/mol) 250.31
MDL Number MFCD03095437
SMILES COS([O-])(=O)=O.CCCCN1C=C[N+](C)=C1
Synonym 1-butyl-3-methylimidazolium methyl sulfate,1-butyl-3-methylimidazolium methylsulfate,bmimmeso4,1-n-butyl-3-methylimidazolium methylsulfate,1-butyl-3-methylimidazolium methyl sulfate 1-,acmc-20aowh,basionics™ lq 02,1-butyl-3-methylimidazolium methylsul-fate,1-butyl-3-methylimidazol-3-ium,methyl sulfate,1-butyl-3-methyl-imidazol-3-ium; methyl sulfate
InChI Key MEMNKNZDROKJHP-UHFFFAOYSA-M
Molecular Formula C9H18N2O4S
13

2-Phenylimidazole, 98%

CAS: 670-96-2 Molecular Formula: C9H8N2 Molecular Weight (g/mol): 144.18 MDL Number: MFCD00005186 InChI Key: ZCUJYXPAKHMBAZ-UHFFFAOYSA-N Synonym: 2-phenylimidazole,1h-imidazole, 2-phenyl,imidazole, 2-phenyl,2-phenyl imidazole,2-phenyl-1h-imidazol,unii-7r2590hm4l,chembl14189,phenyl imidazole,2-phenyl-imidazole,piy PubChem CID: 69591 IUPAC Name: 2-phenyl-1H-imidazole SMILES: N1C=CN=C1C1=CC=CC=C1

PubChem CID 69591
CAS 670-96-2
Molecular Weight (g/mol) 144.18
MDL Number MFCD00005186
SMILES N1C=CN=C1C1=CC=CC=C1
Synonym 2-phenylimidazole,1h-imidazole, 2-phenyl,imidazole, 2-phenyl,2-phenyl imidazole,2-phenyl-1h-imidazol,unii-7r2590hm4l,chembl14189,phenyl imidazole,2-phenyl-imidazole,piy
IUPAC Name 2-phenyl-1H-imidazole
InChI Key ZCUJYXPAKHMBAZ-UHFFFAOYSA-N
Molecular Formula C9H8N2
14

1,3-Diisopropylimidazolium chloride, 97+%

CAS: 139143-09-2 Molecular Formula: C9H17ClN2 Molecular Weight (g/mol): 188.70 MDL Number: MFCD03840577 InChI Key: DOFXKPAOJLLPII-UHFFFAOYSA-M Synonym: 1,3-diisopropylimidazolium chloride,1,3-di-i-propylimidazolium chloride,1,3-diisopropyl-1h-imidazol-3-ium chloride,1,3-diisopropylimidazol-1-ium chloride,diic,acmc-20ap45,n,n'-isopropyl imidazolium chloride,1h-imidazolium,1,3-bis 1-methylethyl-, chloride 1:1,n,n inverted exclamation marka-isopropyl imidazolium chloride PubChem CID: 11229242 IUPAC Name: 1,3-di(propan-2-yl)imidazol-1-ium;chloride SMILES: [Cl-].CC(C)N1C=C[N+](=C1)C(C)C

PubChem CID 11229242
CAS 139143-09-2
Molecular Weight (g/mol) 188.70
MDL Number MFCD03840577
SMILES [Cl-].CC(C)N1C=C[N+](=C1)C(C)C
Synonym 1,3-diisopropylimidazolium chloride,1,3-di-i-propylimidazolium chloride,1,3-diisopropyl-1h-imidazol-3-ium chloride,1,3-diisopropylimidazol-1-ium chloride,diic,acmc-20ap45,n,n'-isopropyl imidazolium chloride,1h-imidazolium,1,3-bis 1-methylethyl-, chloride 1:1,n,n inverted exclamation marka-isopropyl imidazolium chloride
IUPAC Name 1,3-di(propan-2-yl)imidazol-1-ium;chloride
InChI Key DOFXKPAOJLLPII-UHFFFAOYSA-M
Molecular Formula C9H17ClN2
15

1-n-Hexyl-3-methylimidazolium chloride, 98%

CAS: 171058-17-6 Molecular Formula: C10H19N2 Molecular Weight (g/mol): 167.28 MDL Number: MFCD03093289 InChI Key: RVEJOWGVUQQIIZ-UHFFFAOYSA-N Synonym: 1-hexyl-3-methylimidazolium chloride,hmimcl,1-hexyl-3-methyl-1h-imidazol-3-ium chloride,1-hexyl-3-methylimidazol-3-ium chloride,hmim cl,acmc-209e2c,dsstox_cid_27924,dsstox_rid_82677,dsstox_gsid_47948,ksc491c7f PubChem CID: 2734163 ChEBI: CHEBI:61340 IUPAC Name: 1-hexyl-3-methylimidazol-3-ium;chloride SMILES: CCCCCC[N+]1=CN(C)C=C1

PubChem CID 2734163
CAS 171058-17-6
Molecular Weight (g/mol) 167.28
ChEBI CHEBI:61340
MDL Number MFCD03093289
SMILES CCCCCC[N+]1=CN(C)C=C1
Synonym 1-hexyl-3-methylimidazolium chloride,hmimcl,1-hexyl-3-methyl-1h-imidazol-3-ium chloride,1-hexyl-3-methylimidazol-3-ium chloride,hmim cl,acmc-209e2c,dsstox_cid_27924,dsstox_rid_82677,dsstox_gsid_47948,ksc491c7f
IUPAC Name 1-hexyl-3-methylimidazol-3-ium;chloride
InChI Key RVEJOWGVUQQIIZ-UHFFFAOYSA-N
Molecular Formula C10H19N2