Monocarboxylic acids and derivatives

Organic compounds that contain one carboxyl group; carboxyl groups consist of a carbonyl group bonded to a hydroxy group. Includes compounds that are derived from monocarboxylic acids.

1 – 15 of 299 results

Levulinic acid, 98%

CAS: 123-76-2 Molecular Formula: C5H8O3 Molecular Weight (g/mol): 116.116 MDL Number: MFCD00002796 InChI Key: JOOXCMJARBKPKM-UHFFFAOYSA-N Synonym: levulinic acid,laevulinic acid,pentanoic acid, 4-oxo,levulic acid,4-oxovaleric acid,3-acetylpropionic acid,4-ketovaleric acid,leva,gamma-ketovaleric acid,acetopropionic acid PubChem CID: 11579 ChEBI: CHEBI:45630 IUPAC Name: 4-oxopentanoic acid SMILES: CC(=O)CCC(=O)O

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Specifications

PubChem CID	11579
CAS	123-76-2
Molecular Weight (g/mol)	116.116
ChEBI	CHEBI:45630
MDL Number	MFCD00002796
SMILES	CC(=O)CCC(=O)O
Synonym	levulinic acid,laevulinic acid,pentanoic acid, 4-oxo,levulic acid,4-oxovaleric acid,3-acetylpropionic acid,4-ketovaleric acid,leva,gamma-ketovaleric acid,acetopropionic acid
IUPAC Name	4-oxopentanoic acid
InChI Key	JOOXCMJARBKPKM-UHFFFAOYSA-N
Molecular Formula	C5H8O3

Ammonium formate, 97%

CAS: 540-69-2 Molecular Formula: CH5NO2 Molecular Weight (g/mol): 63.056 MDL Number: MFCD00013103 InChI Key: VZTDIZULWFCMLS-UHFFFAOYSA-N Synonym: ammonium formate,formic acid, ammonium salt,formic acid ammonium salt,ammoniumformate,azanium formate,ammonium formiate,formic acid, ammonium salt 1:1,mravencan amonny czech,hsdb 479,mravencan amonny PubChem CID: 2723923 ChEBI: CHEBI:63050 IUPAC Name: azanium;formate SMILES: C(=O)[O-].[NH4+]

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PubChem CID	2723923
CAS	540-69-2
Molecular Weight (g/mol)	63.056
ChEBI	CHEBI:63050
MDL Number	MFCD00013103
SMILES	C(=O)[O-].[NH4+]
Synonym	ammonium formate,formic acid, ammonium salt,formic acid ammonium salt,ammoniumformate,azanium formate,ammonium formiate,formic acid, ammonium salt 1:1,mravencan amonny czech,hsdb 479,mravencan amonny
IUPAC Name	azanium;formate
InChI Key	VZTDIZULWFCMLS-UHFFFAOYSA-N
Molecular Formula	CH5NO2

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Ammonium acetate, 97%

CAS: 631-61-8 Molecular Formula: C2H7NO2 Molecular Weight (g/mol): 77.083 MDL Number: MFCD00013066 InChI Key: USFZMSVCRYTOJT-UHFFFAOYSA-N Synonym: ammonium acetate,acetic acid, ammonium salt,azanium acetate,ammoniumacetate,acetic acid ammonium salt,ammonium ethanoate,unii-rre756s6q2,aconh4,ch3coonh4,ch3co2nh4 PubChem CID: 517165 ChEBI: CHEBI:62947 IUPAC Name: azanium;acetate SMILES: CC(=O)[O-].[NH4+]

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PubChem CID	517165
CAS	631-61-8
Molecular Weight (g/mol)	77.083
ChEBI	CHEBI:62947
MDL Number	MFCD00013066
SMILES	CC(=O)[O-].[NH4+]
Synonym	ammonium acetate,acetic acid, ammonium salt,azanium acetate,ammoniumacetate,acetic acid ammonium salt,ammonium ethanoate,unii-rre756s6q2,aconh4,ch3coonh4,ch3co2nh4
IUPAC Name	azanium;acetate
InChI Key	USFZMSVCRYTOJT-UHFFFAOYSA-N
Molecular Formula	C2H7NO2

Barium acetate, 99%

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2-Phenylethyl acetate, 98%

CAS: 103-45-7 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.20 MDL Number: MFCD00008720 InChI Key: MDHYEMXUFSJLGV-UHFFFAOYSA-N Synonym: phenethyl acetate,2-phenethyl acetate,acetic acid, 2-phenylethyl ester,benzylcarbinyl acetate,beta-phenylethyl acetate,acetic acid, phenethyl ester,phenethyl alcohol, acetate,phenylethyl acetate,acetic acid phenethyl ester,ethanol, 2-phenyl-, acetate PubChem CID: 7654 ChEBI: CHEBI:31988 IUPAC Name: 2-phenylethyl acetate SMILES: CC(=O)OCCC1=CC=CC=C1

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Specifications

PubChem CID	7654
CAS	103-45-7
Molecular Weight (g/mol)	164.20
ChEBI	CHEBI:31988
MDL Number	MFCD00008720
SMILES	CC(=O)OCCC1=CC=CC=C1
Synonym	phenethyl acetate,2-phenethyl acetate,acetic acid, 2-phenylethyl ester,benzylcarbinyl acetate,beta-phenylethyl acetate,acetic acid, phenethyl ester,phenethyl alcohol, acetate,phenylethyl acetate,acetic acid phenethyl ester,ethanol, 2-phenyl-, acetate
IUPAC Name	2-phenylethyl acetate
InChI Key	MDHYEMXUFSJLGV-UHFFFAOYSA-N
Molecular Formula	C10H12O2

L-Lactic acid, anhydrous, 98%

CAS: 79-33-4 Molecular Formula: C3H6O3 Molecular Weight (g/mol): 90.078 MDL Number: MFCD00064266 InChI Key: JVTAAEKCZFNVCJ-REOHCLBHSA-N Synonym: l-lactic acid,l-+-lactic acid,s-2-hydroxypropanoic acid,s-lactic acid,sarcolactic acid,s-2-hydroxypropionic acid,2s-2-hydroxypropanoic acid,+-lactic acid,espiritin,tisulac PubChem CID: 107689 ChEBI: CHEBI:422 IUPAC Name: (2S)-2-hydroxypropanoic acid SMILES: CC(C(=O)O)O

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Specifications

PubChem CID	107689
CAS	79-33-4
Molecular Weight (g/mol)	90.078
ChEBI	CHEBI:422
MDL Number	MFCD00064266
SMILES	CC(C(=O)O)O
Synonym	l-lactic acid,l-+-lactic acid,s-2-hydroxypropanoic acid,s-lactic acid,sarcolactic acid,s-2-hydroxypropionic acid,2s-2-hydroxypropanoic acid,+-lactic acid,espiritin,tisulac
IUPAC Name	(2S)-2-hydroxypropanoic acid
InChI Key	JVTAAEKCZFNVCJ-REOHCLBHSA-N
Molecular Formula	C3H6O3

Ethyl cyanoacetate, 98+%

CAS: 105-56-6 Molecular Formula: C5H7NO2 Molecular Weight (g/mol): 113.12 MDL Number: MFCD00001940 InChI Key: ZIUSEGSNTOUIPT-UHFFFAOYSA-N Synonym: ethyl cyanoacetate,ethyl cyanacetate,cyanoacetic acid ethyl ester,acetic acid, cyano-, ethyl ester,ethyl cyanoethanoate,cyanoacetic ester,cyanacetate ethyle,usaf kf-25,estere cianoacetico,ethyl cyano acetate PubChem CID: 7764 IUPAC Name: ethyl 2-cyanoacetate SMILES: CCOC(=O)CC#N

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Specifications

PubChem CID	7764
CAS	105-56-6
Molecular Weight (g/mol)	113.12
MDL Number	MFCD00001940
SMILES	CCOC(=O)CC#N
Synonym	ethyl cyanoacetate,ethyl cyanacetate,cyanoacetic acid ethyl ester,acetic acid, cyano-, ethyl ester,ethyl cyanoethanoate,cyanoacetic ester,cyanacetate ethyle,usaf kf-25,estere cianoacetico,ethyl cyano acetate
IUPAC Name	ethyl 2-cyanoacetate
InChI Key	ZIUSEGSNTOUIPT-UHFFFAOYSA-N
Molecular Formula	C5H7NO2

3,3-Dimethylallyl acetate, 98%, stab. with 0.1% alpha tocopherol, Thermo Scientific Chemicals

CAS: 1191-16-8 Molecular Formula: C7H12O2 Molecular Weight (g/mol): 128.17 MDL Number: MFCD00036569 InChI Key: XXIKYCPRDXIMQM-UHFFFAOYSA-N Synonym: prenyl acetate,3,3-dimethylallyl acetate,3-methyl-2-butenyl acetate,isopent-2-enyl acetate,3-methylbut-2-en-1-yl acetate,dimethylallyl acetate,2-buten-1-ol, 3-methyl-, acetate,3-methyl-2-buten-1-ol, acetate,unii-i7kov03hgs,isopentenyl acetate PubChem CID: 14489 IUPAC Name: 3-methylbut-2-enyl acetate SMILES: CC(C)=CCOC(C)=O

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Specifications

PubChem CID	14489
CAS	1191-16-8
Molecular Weight (g/mol)	128.17
MDL Number	MFCD00036569
SMILES	CC(C)=CCOC(C)=O
Synonym	prenyl acetate,3,3-dimethylallyl acetate,3-methyl-2-butenyl acetate,isopent-2-enyl acetate,3-methylbut-2-en-1-yl acetate,dimethylallyl acetate,2-buten-1-ol, 3-methyl-, acetate,3-methyl-2-buten-1-ol, acetate,unii-i7kov03hgs,isopentenyl acetate
IUPAC Name	3-methylbut-2-enyl acetate
InChI Key	XXIKYCPRDXIMQM-UHFFFAOYSA-N
Molecular Formula	C7H12O2

n-Butyl acetate, 99+%

CAS: 123-86-4 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00009445 InChI Key: DKPFZGUDAPQIHT-UHFFFAOYSA-N Synonym: n-butyl acetate,acetic acid, butyl ester,1-butyl acetate,butyl ethanoate,acetic acid butyl ester,n-butyl ethanoate,n-butylacetate,butylacetat,acetic acid n-butyl ester,acetate de butyle PubChem CID: 31272 ChEBI: CHEBI:31328 IUPAC Name: butyl acetate SMILES: CCCCOC(C)=O

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Specifications

PubChem CID	31272
CAS	123-86-4
Molecular Weight (g/mol)	116.16
ChEBI	CHEBI:31328
MDL Number	MFCD00009445
SMILES	CCCCOC(C)=O
Synonym	n-butyl acetate,acetic acid, butyl ester,1-butyl acetate,butyl ethanoate,acetic acid butyl ester,n-butyl ethanoate,n-butylacetate,butylacetat,acetic acid n-butyl ester,acetate de butyle
IUPAC Name	butyl acetate
InChI Key	DKPFZGUDAPQIHT-UHFFFAOYSA-N
Molecular Formula	C6H12O2

Cyanoacetic acid, 97%

CAS: 372-09-8 Molecular Formula: C3H3NO2 Molecular Weight (g/mol): 85.062 MDL Number: MFCD00002677 InChI Key: MLIREBYILWEBDM-UHFFFAOYSA-N Synonym: cyanoacetic acid,acetic acid, cyano,malonic mononitrile,acide cyanacetique,cyanessigsaeure,monocyanoacetic acid,malonic acid mononitrile,usaf kf-17,cyanoethanoic acid,kyselina kyanoctova PubChem CID: 9740 ChEBI: CHEBI:51889 IUPAC Name: 2-cyanoacetic acid SMILES: C(C#N)C(=O)O

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Specifications

PubChem CID	9740
CAS	372-09-8
Molecular Weight (g/mol)	85.062
ChEBI	CHEBI:51889
MDL Number	MFCD00002677
SMILES	C(C#N)C(=O)O
Synonym	cyanoacetic acid,acetic acid, cyano,malonic mononitrile,acide cyanacetique,cyanessigsaeure,monocyanoacetic acid,malonic acid mononitrile,usaf kf-17,cyanoethanoic acid,kyselina kyanoctova
IUPAC Name	2-cyanoacetic acid
InChI Key	MLIREBYILWEBDM-UHFFFAOYSA-N
Molecular Formula	C3H3NO2

Nickel(II) acetate tetrahydrate, 98+%

CAS: 6018-89-9 Molecular Formula: C4H14NiO8 Molecular Weight (g/mol): 248.84 MDL Number: MFCD00066973 InChI Key: OINIXPNQKAZCRL-UHFFFAOYSA-L Synonym: nickel ii acetate tetrahydrate,nickel acetate tetrahydrate,nickel diacetate tetrahydrate,diacetatonickel tetrahydrate,nickelous acetate tetrahydrate,unii-6soa8l0560,acetic acid, nickel +2 salt, tetrahydrate,nickel 2+ diacetate tetrahydrate,nickel acetate tetrahydrate nickel and nickel compounds,acetic acid, nickel 2+ salt, tetrahydrate PubChem CID: 62601 IUPAC Name: nickel(2+);diacetate;tetrahydrate SMILES: O.O.O.O.[Ni++].CC([O-])=O.CC([O-])=O

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Specifications

PubChem CID	62601
CAS	6018-89-9
Molecular Weight (g/mol)	248.84
MDL Number	MFCD00066973
SMILES	O.O.O.O.[Ni++].CC([O-])=O.CC([O-])=O
Synonym	nickel ii acetate tetrahydrate,nickel acetate tetrahydrate,nickel diacetate tetrahydrate,diacetatonickel tetrahydrate,nickelous acetate tetrahydrate,unii-6soa8l0560,acetic acid, nickel +2 salt, tetrahydrate,nickel 2+ diacetate tetrahydrate,nickel acetate tetrahydrate nickel and nickel compounds,acetic acid, nickel 2+ salt, tetrahydrate
IUPAC Name	nickel(2+);diacetate;tetrahydrate
InChI Key	OINIXPNQKAZCRL-UHFFFAOYSA-L
Molecular Formula	C4H14NiO8

Phenylpropiolic acid, 98+%

CAS: 637-44-5 Molecular Formula: C9H6O2 Molecular Weight (g/mol): 146.15 MDL Number: MFCD00004361 InChI Key: XNERWVPQCYSMLC-UHFFFAOYSA-N Synonym: phenylpropiolic acid,3-phenylpropiolic acid,phenylpropynoic acid,3-phenylpropynoic acid,2-propynoic acid, 3-phenyl,phenylacetylenecarboxylic acid,3-phenyl-2-propynoic acid,phenylacetylene monocarboxylic acid,propiolic acid, 3-phenyl,phenyl propiolic acid PubChem CID: 69475 IUPAC Name: 3-phenylprop-2-ynoic acid SMILES: OC(=O)C#CC1=CC=CC=C1

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Specifications

PubChem CID	69475
CAS	637-44-5
Molecular Weight (g/mol)	146.15
MDL Number	MFCD00004361
SMILES	OC(=O)C#CC1=CC=CC=C1
Synonym	phenylpropiolic acid,3-phenylpropiolic acid,phenylpropynoic acid,3-phenylpropynoic acid,2-propynoic acid, 3-phenyl,phenylacetylenecarboxylic acid,3-phenyl-2-propynoic acid,phenylacetylene monocarboxylic acid,propiolic acid, 3-phenyl,phenyl propiolic acid
IUPAC Name	3-phenylprop-2-ynoic acid
InChI Key	XNERWVPQCYSMLC-UHFFFAOYSA-N
Molecular Formula	C9H6O2

1-Naphthyl acetate, 99%

CAS: 830-81-9 Molecular Formula: C12H10O2 Molecular Weight (g/mol): 186.21 MDL Number: MFCD00003922 InChI Key: VGKONPUVOVVNSU-UHFFFAOYSA-N Synonym: 1-naphthyl acetate,1-acetoxynaphthalene,alpha-naphthyl acetate,1-naphthol, acetate,a-naphthyl acetate,naphthyl acetate,naphthalene, 1-acetoxy,1-naphthalenol, acetate,acetic acid 1-naphthyl ester,alpha-naphthol acetate PubChem CID: 13247 IUPAC Name: naphthalen-1-yl acetate SMILES: CC(=O)OC1=CC=CC2=CC=CC=C21

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Specifications

PubChem CID	13247
CAS	830-81-9
Molecular Weight (g/mol)	186.21
MDL Number	MFCD00003922
SMILES	CC(=O)OC1=CC=CC2=CC=CC=C21
Synonym	1-naphthyl acetate,1-acetoxynaphthalene,alpha-naphthyl acetate,1-naphthol, acetate,a-naphthyl acetate,naphthyl acetate,naphthalene, 1-acetoxy,1-naphthalenol, acetate,acetic acid 1-naphthyl ester,alpha-naphthol acetate
IUPAC Name	naphthalen-1-yl acetate
InChI Key	VGKONPUVOVVNSU-UHFFFAOYSA-N
Molecular Formula	C12H10O2

Isopropyl acetate, 99+%

CAS: 108-21-4 Molecular Formula: C5H10O2 Molecular Weight (g/mol): 102.133 MDL Number: MFCD00008877 InChI Key: JMMWKPVZQRWMSS-UHFFFAOYSA-N Synonym: isopropyl acetate,2-propyl acetate,2-acetoxypropane,acetic acid, 1-methylethyl ester,isopropyl ethanoate,isopropylacetat,paracetat,isopropylacetaat,1-methylethyl acetate,acetic acid, isopropyl ester PubChem CID: 7915 IUPAC Name: propan-2-yl acetate SMILES: CC(C)OC(=O)C

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Specifications

PubChem CID	7915
CAS	108-21-4
Molecular Weight (g/mol)	102.133
MDL Number	MFCD00008877
SMILES	CC(C)OC(=O)C
Synonym	isopropyl acetate,2-propyl acetate,2-acetoxypropane,acetic acid, 1-methylethyl ester,isopropyl ethanoate,isopropylacetat,paracetat,isopropylacetaat,1-methylethyl acetate,acetic acid, isopropyl ester
IUPAC Name	propan-2-yl acetate
InChI Key	JMMWKPVZQRWMSS-UHFFFAOYSA-N
Molecular Formula	C5H10O2

Zinc acetate dihydrate, 97+%

CAS: 5970-45-6 Molecular Formula: C4H10O6Zn MDL Number: MFCD00066961 InChI Key: BEAZKUGSCHFXIQ-UHFFFAOYSA-L Synonym: zinc acetate dihydrate,zinc diacetate dihydrate,zinc ii acetate dihydrate,unii-fm5526k07a,acetic acid zinc salt,zinc acetate usp,acetic acid, zinc salt, dihydrate,zinc acetate, dihydrate,galzin tn PubChem CID: 2724192 IUPAC Name: zinc;diacetate;dihydrate

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Specifications

PubChem CID	2724192
CAS	5970-45-6
MDL Number	MFCD00066961
Synonym	zinc acetate dihydrate,zinc diacetate dihydrate,zinc ii acetate dihydrate,unii-fm5526k07a,acetic acid zinc salt,zinc acetate usp,acetic acid, zinc salt, dihydrate,zinc acetate, dihydrate,galzin tn
IUPAC Name	zinc;diacetate;dihydrate
InChI Key	BEAZKUGSCHFXIQ-UHFFFAOYSA-L
Molecular Formula	C4H10O6Zn

Monocarboxylic acids and derivatives

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