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Isoxazoles

Aromatic organic heterocyclic compounds that consist of an azole with a nitrogen atom and an oxygen atom with the formula: C3H3NO.
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1 – 15 of 96 results
1

2-Methyl-2-phenylpropylmagnesium chloride, 0.5M solution in diethyl ether, AcroSeal™

CAS: 35293-35-7 Molecular Formula: C10H13ClMg Molecular Weight (g/mol): 192.97 MDL Number: MFCD00075586 InChI Key: BXKYFONHSSFLKR-UHFFFAOYSA-M Synonym: neophylmagnesium chloride,chloro 2-methyl-2-phenylpropyl magnesium,magnesium, chloro 2-methyl-2-phenylpropyl,2-methyl-2-phenylpropylmagnesium chloride,2-methyl-2-phenylpropylmagnesium chloride solution,neophyl magnesium chloride,bxkyfonhssflkr-uhfffaoysa-m,2-methyl-2-phenylpropyl magnesium chloride,2-methyl-2-phenyl-propanyl magnesium chloride,2-methyl-2-phenylpropylmagnesium chloride solution, 0.5 m in diethyl ether PubChem CID: 118802 IUPAC Name: magnesium;2-methanidylpropan-2-ylbenzene;chloride SMILES: CC(C)(C[Mg]Cl)C1=CC=CC=C1

PubChem CID 118802
CAS 35293-35-7
Molecular Weight (g/mol) 192.97
MDL Number MFCD00075586
SMILES CC(C)(C[Mg]Cl)C1=CC=CC=C1
Synonym neophylmagnesium chloride,chloro 2-methyl-2-phenylpropyl magnesium,magnesium, chloro 2-methyl-2-phenylpropyl,2-methyl-2-phenylpropylmagnesium chloride,2-methyl-2-phenylpropylmagnesium chloride solution,neophyl magnesium chloride,bxkyfonhssflkr-uhfffaoysa-m,2-methyl-2-phenylpropyl magnesium chloride,2-methyl-2-phenyl-propanyl magnesium chloride,2-methyl-2-phenylpropylmagnesium chloride solution, 0.5 m in diethyl ether
IUPAC Name magnesium;2-methanidylpropan-2-ylbenzene;chloride
InChI Key BXKYFONHSSFLKR-UHFFFAOYSA-M
Molecular Formula C10H13ClMg
2

7-Methylbenzo[d]isoxazol-3-ol, 97%, Thermo Scientific™

CAS: 36238-83-2 Molecular Formula: C8H7NO2 Molecular Weight (g/mol): 149.149 MDL Number: MFCD00104669 InChI Key: JUNCQBPTXAQOSA-UHFFFAOYSA-N Synonym: 7-methylbenzo d isoxazol-3-ol,7-methylbenzo d isoxazol-3 2h-one,7-methyl-1,2-benzoxazol-3-ol,3-hydroxy-7-methyl-1,2-benzisoxazole,7-methyl-2h-1,2-benzoxazol-3-one,7-methyl-benzo d isoxazol-3-ol,3-hydroxy-7-methyl-1,2-benzisoxazol,benzo d isoxazol-3-ol derivative, 3n,1,2-benzisoxazol-3 2h-one,7-methyl,7-methyl-1,2-benzoisoxazole-3 2h-one PubChem CID: 2782122 IUPAC Name: 7-methyl-1,2-benzoxazol-3-one SMILES: CC1=CC=CC2=C1ONC2=O

PubChem CID 2782122
CAS 36238-83-2
Molecular Weight (g/mol) 149.149
MDL Number MFCD00104669
SMILES CC1=CC=CC2=C1ONC2=O
Synonym 7-methylbenzo d isoxazol-3-ol,7-methylbenzo d isoxazol-3 2h-one,7-methyl-1,2-benzoxazol-3-ol,3-hydroxy-7-methyl-1,2-benzisoxazole,7-methyl-2h-1,2-benzoxazol-3-one,7-methyl-benzo d isoxazol-3-ol,3-hydroxy-7-methyl-1,2-benzisoxazol,benzo d isoxazol-3-ol derivative, 3n,1,2-benzisoxazol-3 2h-one,7-methyl,7-methyl-1,2-benzoisoxazole-3 2h-one
IUPAC Name 7-methyl-1,2-benzoxazol-3-one
InChI Key JUNCQBPTXAQOSA-UHFFFAOYSA-N
Molecular Formula C8H7NO2
3

(5-Methylisoxazol-3-yl)methanol, 97%, Thermo Scientific™

CAS: 35166-33-7 Molecular Formula: C5H7NO2 Molecular Weight (g/mol): 113.12 MDL Number: MFCD00085129 InChI Key: MDYHWQQHEWDJKR-UHFFFAOYSA-N Synonym: 5-methylisoxazol-3-yl methanol,3-hydroxymethyl-5-methylisoxazole,5-methyl-1,2-oxazol-3-yl methanol,5-methyl-3-isoxazolemethanol,5-methyl-isoxazol-3-yl-methanol,5-methylisoxazole-3-methanol,5-methyl-3-isoxazolyl methanol,5-methyl-isoxazol-3-yl methanol,3-isoxazolemethanol, 5-methyl PubChem CID: 2736567 IUPAC Name: (5-methyl-1,2-oxazol-3-yl)methanol SMILES: CC1=CC(CO)=NO1

PubChem CID 2736567
CAS 35166-33-7
Molecular Weight (g/mol) 113.12
MDL Number MFCD00085129
SMILES CC1=CC(CO)=NO1
Synonym 5-methylisoxazol-3-yl methanol,3-hydroxymethyl-5-methylisoxazole,5-methyl-1,2-oxazol-3-yl methanol,5-methyl-3-isoxazolemethanol,5-methyl-isoxazol-3-yl-methanol,5-methylisoxazole-3-methanol,5-methyl-3-isoxazolyl methanol,5-methyl-isoxazol-3-yl methanol,3-isoxazolemethanol, 5-methyl
IUPAC Name (5-methyl-1,2-oxazol-3-yl)methanol
InChI Key MDYHWQQHEWDJKR-UHFFFAOYSA-N
Molecular Formula C5H7NO2
4

3-methyl-4-isoxazolecarboxylic acid, 97%, Thermo Scientific™

CAS: 17153-20-7 Molecular Formula: C5H5NO3 Molecular Weight (g/mol): 127.099 InChI Key: YBLSBWHFPXDRHC-UHFFFAOYSA-N Synonym: 3-methylisoxazole-4-carboxylic acid,3-methyl-4-isoxazolecarboxylic acid,3-methyl-4-isoxazolecarboxylicacid,3-methyl-isoxazole-4-carboxylic acid,4-isoxazolecarboxylic acid, 3-methyl,3-methylisoxazole-4-carboxylicacid,pubchem10465,acmc-1c78i,3-methylisoxazole-s-carboxylic acid,4-isoxazolecarboxylicacid,3-methyl PubChem CID: 4589692 IUPAC Name: 3-methyl-1,2-oxazole-4-carboxylic acid SMILES: CC1=NOC=C1C(=O)O

PubChem CID 4589692
CAS 17153-20-7
Molecular Weight (g/mol) 127.099
SMILES CC1=NOC=C1C(=O)O
Synonym 3-methylisoxazole-4-carboxylic acid,3-methyl-4-isoxazolecarboxylic acid,3-methyl-4-isoxazolecarboxylicacid,3-methyl-isoxazole-4-carboxylic acid,4-isoxazolecarboxylic acid, 3-methyl,3-methylisoxazole-4-carboxylicacid,pubchem10465,acmc-1c78i,3-methylisoxazole-s-carboxylic acid,4-isoxazolecarboxylicacid,3-methyl
IUPAC Name 3-methyl-1,2-oxazole-4-carboxylic acid
InChI Key YBLSBWHFPXDRHC-UHFFFAOYSA-N
Molecular Formula C5H5NO3
5

3-Methylisoxazole-5-carboxylic acid, 97%, Thermo Scientific™

CAS: 4857-42-5 Molecular Formula: C5H5NO3 Molecular Weight (g/mol): 127.099 MDL Number: MFCD00464222 InChI Key: HXIYCKAAQPHZBM-UHFFFAOYSA-N Synonym: 3-methylisoxazole-5-carboxylic acid,3-methyl-5-isoxazolecarboxylic acid,5-isoxazolecarboxylic acid, 3-methyl,3-methyl-isoxazole-5-carboxylic acid,5-carboxy-3-methylisoxazole,5-isoxazolecarboxylicacid, 3-methyl,3-methylisoxazole-5-carboxylicacid,acmc-1aruu,3-methyl-5-carboxyisoxazole,aronis24519 PubChem CID: 853085 IUPAC Name: 3-methyl-1,2-oxazole-5-carboxylic acid SMILES: CC1=NOC(=C1)C(=O)O

PubChem CID 853085
CAS 4857-42-5
Molecular Weight (g/mol) 127.099
MDL Number MFCD00464222
SMILES CC1=NOC(=C1)C(=O)O
Synonym 3-methylisoxazole-5-carboxylic acid,3-methyl-5-isoxazolecarboxylic acid,5-isoxazolecarboxylic acid, 3-methyl,3-methyl-isoxazole-5-carboxylic acid,5-carboxy-3-methylisoxazole,5-isoxazolecarboxylicacid, 3-methyl,3-methylisoxazole-5-carboxylicacid,acmc-1aruu,3-methyl-5-carboxyisoxazole,aronis24519
IUPAC Name 3-methyl-1,2-oxazole-5-carboxylic acid
InChI Key HXIYCKAAQPHZBM-UHFFFAOYSA-N
Molecular Formula C5H5NO3
6

3-Methylisoxazole-4-carboxylic acid, 98+%, Thermo Scientific Chemicals

CAS: 17153-20-7 Molecular Formula: C5H5NO3 Molecular Weight (g/mol): 127.099 MDL Number: MFCD01318161 InChI Key: YBLSBWHFPXDRHC-UHFFFAOYSA-N Synonym: 3-methylisoxazole-4-carboxylic acid,3-methyl-4-isoxazolecarboxylic acid,3-methyl-4-isoxazolecarboxylicacid,3-methyl-isoxazole-4-carboxylic acid,4-isoxazolecarboxylic acid, 3-methyl,3-methylisoxazole-4-carboxylicacid,pubchem10465,acmc-1c78i,3-methylisoxazole-s-carboxylic acid,4-isoxazolecarboxylicacid,3-methyl PubChem CID: 4589692 IUPAC Name: 3-methyl-1,2-oxazole-4-carboxylic acid SMILES: CC1=NOC=C1C(=O)O

PubChem CID 4589692
CAS 17153-20-7
Molecular Weight (g/mol) 127.099
MDL Number MFCD01318161
SMILES CC1=NOC=C1C(=O)O
Synonym 3-methylisoxazole-4-carboxylic acid,3-methyl-4-isoxazolecarboxylic acid,3-methyl-4-isoxazolecarboxylicacid,3-methyl-isoxazole-4-carboxylic acid,4-isoxazolecarboxylic acid, 3-methyl,3-methylisoxazole-4-carboxylicacid,pubchem10465,acmc-1c78i,3-methylisoxazole-s-carboxylic acid,4-isoxazolecarboxylicacid,3-methyl
IUPAC Name 3-methyl-1,2-oxazole-4-carboxylic acid
InChI Key YBLSBWHFPXDRHC-UHFFFAOYSA-N
Molecular Formula C5H5NO3
7

5-Methyl-3-isoxazolecarbonitrile, 97%, Thermo Scientific™

CAS: 57351-99-2 Molecular Formula: C5H4N2O Molecular Weight (g/mol): 108.10 MDL Number: MFCD09064940 InChI Key: JTPIMYCMWLOEDD-UHFFFAOYSA-N PubChem CID: 24229456 IUPAC Name: 5-methyl-1,2-oxazole-3-carbonitrile SMILES: CC1=CC(=NO1)C#N

PubChem CID 24229456
CAS 57351-99-2
Molecular Weight (g/mol) 108.10
MDL Number MFCD09064940
SMILES CC1=CC(=NO1)C#N
IUPAC Name 5-methyl-1,2-oxazole-3-carbonitrile
InChI Key JTPIMYCMWLOEDD-UHFFFAOYSA-N
Molecular Formula C5H4N2O
8

3,5-Dimethylisoxazole-4-carboxylic acid, 97%, Thermo Scientific™

CAS: 2510-36-3 Molecular Formula: C6H7NO3 Molecular Weight (g/mol): 141.126 InChI Key: IJEUISLJVBUNRE-UHFFFAOYSA-N Synonym: 3,5-dimethylisoxazole-4-carboxylic acid,3,5-dimethylisoxasole-4-carboxylic acid,4-isoxazolecarboxylic acid, 3,5-dimethyl,dimethyl-1,2-oxazole-4-carboxylic acid,3,5-dimethyl-4-isoxazolecarboxylic acid,3,5-dimethyl-isoxazole-4-carboxylic acid,3,5-dimethylisoxazole-4-carboxylicacid,pubchem8774,akos pao-1555 PubChem CID: 75636 IUPAC Name: 3,5-dimethyl-1,2-oxazole-4-carboxylic acid SMILES: CC1=C(C(=NO1)C)C(=O)O

PubChem CID 75636
CAS 2510-36-3
Molecular Weight (g/mol) 141.126
SMILES CC1=C(C(=NO1)C)C(=O)O
Synonym 3,5-dimethylisoxazole-4-carboxylic acid,3,5-dimethylisoxasole-4-carboxylic acid,4-isoxazolecarboxylic acid, 3,5-dimethyl,dimethyl-1,2-oxazole-4-carboxylic acid,3,5-dimethyl-4-isoxazolecarboxylic acid,3,5-dimethyl-isoxazole-4-carboxylic acid,3,5-dimethylisoxazole-4-carboxylicacid,pubchem8774,akos pao-1555
IUPAC Name 3,5-dimethyl-1,2-oxazole-4-carboxylic acid
InChI Key IJEUISLJVBUNRE-UHFFFAOYSA-N
Molecular Formula C6H7NO3
9

(5-Phenylisoxazol-3-yl)methanol, 97%, Thermo Scientific™

CAS: 1619-37-0 Molecular Formula: C10H9NO2 Molecular Weight (g/mol): 175.187 MDL Number: MFCD01444104 InChI Key: BPAFLGGUEBMWRN-UHFFFAOYSA-N PubChem CID: 1481082 IUPAC Name: (5-phenyl-1,2-oxazol-3-yl)methanol SMILES: C1=CC=C(C=C1)C2=CC(=NO2)CO

PubChem CID 1481082
CAS 1619-37-0
Molecular Weight (g/mol) 175.187
MDL Number MFCD01444104
SMILES C1=CC=C(C=C1)C2=CC(=NO2)CO
IUPAC Name (5-phenyl-1,2-oxazol-3-yl)methanol
InChI Key BPAFLGGUEBMWRN-UHFFFAOYSA-N
Molecular Formula C10H9NO2
10

3-Methyl-5-phenyl-4-isoxazolecarboxylic acid, 97%, Thermo Scientific™

CAS: 17153-21-8 Molecular Formula: C11H9NO3 Molecular Weight (g/mol): 203.197 InChI Key: GLNQCTGGLIXRRJ-UHFFFAOYSA-N Synonym: 3-methyl-5-phenylisoxazole-4-carboxylic acid,3-methyl-5-phenyl-4-isoxazolecarboxylic acid,4-carboxy-3-methylisoxazol-5-yl benzene,3-methyl-5-phenyl-4-isoxazole carboxylic acid,3-methyl-5-phenyl-isoxazole-4-carboxylic acid,4-isoxazolecarboxylicacid, 3-methyl-5-phenyl,4-isoxazolecarboxylic acid, 3-methyl-5-phenyl PubChem CID: 2776514 IUPAC Name: 3-methyl-5-phenyl-1,2-oxazole-4-carboxylic acid SMILES: CC1=NOC(=C1C(=O)O)C2=CC=CC=C2

PubChem CID 2776514
CAS 17153-21-8
Molecular Weight (g/mol) 203.197
SMILES CC1=NOC(=C1C(=O)O)C2=CC=CC=C2
Synonym 3-methyl-5-phenylisoxazole-4-carboxylic acid,3-methyl-5-phenyl-4-isoxazolecarboxylic acid,4-carboxy-3-methylisoxazol-5-yl benzene,3-methyl-5-phenyl-4-isoxazole carboxylic acid,3-methyl-5-phenyl-isoxazole-4-carboxylic acid,4-isoxazolecarboxylicacid, 3-methyl-5-phenyl,4-isoxazolecarboxylic acid, 3-methyl-5-phenyl
IUPAC Name 3-methyl-5-phenyl-1,2-oxazole-4-carboxylic acid
InChI Key GLNQCTGGLIXRRJ-UHFFFAOYSA-N
Molecular Formula C11H9NO3
11

3-(2,6-Dichlorophenyl)-5-methylisoxazole-4-carboxylic acid, 97%, Thermo Scientific™

CAS: 3919-76-4 Molecular Formula: C11H7Cl2NO3 Molecular Weight (g/mol): 272.08 MDL Number: MFCD00051658 InChI Key: WQXUUMUOERZZAE-UHFFFAOYSA-N Synonym: 3-2,6-dichlorophenyl-5-methylisoxazole-4-carboxylic acid,5-methyl-3-2',6'-dichlorophenyl-4-isoxazolecarboxylic acid,4-isoxazolecarboxylic acid, 3-2,6-dichlorophenyl-5-methyl,3-2,6-dichlorophenyl-5-methyl-1,2-oxazole-4-carboxylic acid,3-2,6-dichlorophenyl-5-methyl-4-isoxazolecarboxylic acid,pubchem8684,dicloxacillin impurity d,acmc-1cmb3,pyridinium hydroxy propyl sulphobetaine; pps-oh,3-2,6-dichlorophenyl-5-methylisoxazol-4-carboxylic acid PubChem CID: 77521 IUPAC Name: 3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxylic acid SMILES: CC1=C(C(O)=O)C(=NO1)C1=C(Cl)C=CC=C1Cl

PubChem CID 77521
CAS 3919-76-4
Molecular Weight (g/mol) 272.08
MDL Number MFCD00051658
SMILES CC1=C(C(O)=O)C(=NO1)C1=C(Cl)C=CC=C1Cl
Synonym 3-2,6-dichlorophenyl-5-methylisoxazole-4-carboxylic acid,5-methyl-3-2',6'-dichlorophenyl-4-isoxazolecarboxylic acid,4-isoxazolecarboxylic acid, 3-2,6-dichlorophenyl-5-methyl,3-2,6-dichlorophenyl-5-methyl-1,2-oxazole-4-carboxylic acid,3-2,6-dichlorophenyl-5-methyl-4-isoxazolecarboxylic acid,pubchem8684,dicloxacillin impurity d,acmc-1cmb3,pyridinium hydroxy propyl sulphobetaine; pps-oh,3-2,6-dichlorophenyl-5-methylisoxazol-4-carboxylic acid
IUPAC Name 3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxylic acid
InChI Key WQXUUMUOERZZAE-UHFFFAOYSA-N
Molecular Formula C11H7Cl2NO3
14

3-(Chloromethyl)-5-phenylisoxazole, ≥97%, Thermo Scientific™

CAS: 14731-10-3 Molecular Formula: C10H8ClNO Molecular Weight (g/mol): 193.63 MDL Number: MFCD01444154 InChI Key: MLJJRVMANUGETQ-UHFFFAOYSA-N PubChem CID: 1484769 IUPAC Name: 3-(chloromethyl)-5-phenyl-1,2-oxazole SMILES: ClCC1=NOC(=C1)C1=CC=CC=C1

PubChem CID 1484769
CAS 14731-10-3
Molecular Weight (g/mol) 193.63
MDL Number MFCD01444154
SMILES ClCC1=NOC(=C1)C1=CC=CC=C1
IUPAC Name 3-(chloromethyl)-5-phenyl-1,2-oxazole
InChI Key MLJJRVMANUGETQ-UHFFFAOYSA-N
Molecular Formula C10H8ClNO
15

Ethyl 5-(hydroxymethyl)isoxazole-3-carboxylate, 90%, Thermo Scientific™

CAS: 123770-62-7 Molecular Formula: C7H9NO4 Molecular Weight (g/mol): 171.152 MDL Number: MFCD08273501 InChI Key: ZWVVVEYXDQMHGQ-UHFFFAOYSA-N Synonym: ethyl 5-hydroxymethyl isoxazole-3-carboxylate,ethyl 5-hydroxymethyl-1,2-oxazole-3-carboxylate,5-hydroxymethylisoxazole-3-carboxylic acid ethyl ester,3-isoxazolecarboxylicacid, 5-hydroxymethyl-, ethyl ester,3-isoxazolecarboxylic acid, 5-hydroxymethyl-, ethyl ester,acmc-1c7ap,ethyl 5-hydroxymethylisoxazole-3-carboxylate,ethyl 5 hydroxymethyl isoxazole-3-carboxylate,ethyl 5-hydroxymethyl-isoxazole-3-carboxylate PubChem CID: 8027233 IUPAC Name: ethyl 5-(hydroxymethyl)-1,2-oxazole-3-carboxylate SMILES: CCOC(=O)C1=NOC(=C1)CO

PubChem CID 8027233
CAS 123770-62-7
Molecular Weight (g/mol) 171.152
MDL Number MFCD08273501
SMILES CCOC(=O)C1=NOC(=C1)CO
Synonym ethyl 5-hydroxymethyl isoxazole-3-carboxylate,ethyl 5-hydroxymethyl-1,2-oxazole-3-carboxylate,5-hydroxymethylisoxazole-3-carboxylic acid ethyl ester,3-isoxazolecarboxylicacid, 5-hydroxymethyl-, ethyl ester,3-isoxazolecarboxylic acid, 5-hydroxymethyl-, ethyl ester,acmc-1c7ap,ethyl 5-hydroxymethylisoxazole-3-carboxylate,ethyl 5 hydroxymethyl isoxazole-3-carboxylate,ethyl 5-hydroxymethyl-isoxazole-3-carboxylate
IUPAC Name ethyl 5-(hydroxymethyl)-1,2-oxazole-3-carboxylate
InChI Key ZWVVVEYXDQMHGQ-UHFFFAOYSA-N
Molecular Formula C7H9NO4