Carboxylic acids and derivatives

Organic compounds that contain a carboxyl group bonded to an organic functional group; carboxyl groups consist of a carbonyl group bonded to a hydroxy group. Includes compounds that are derived from carboxylic acids.

1,036 – 1,050 of 7,490 results

1,036

Ethyl tridecanoate, 97%

CAS: 28267-29-0 Molecular Formula: C15H30O2 Molecular Weight (g/mol): 242.403 MDL Number: MFCD00008978 InChI Key: QJYYMNOTJXIOBP-UHFFFAOYSA-N Synonym: tridecanoic acid ethyl ester,tridecanoic acid, ethyl ester,ethyltridecanoate,ethyl=tridecanoate,tridecanoic acid, ethylester,acmc-1cr51,ethyl tridecanoate,n-tridecanoic acid ethyl ester PubChem CID: 119908 IUPAC Name: ethyl tridecanoate SMILES: CCCCCCCCCCCCC(=O)OCC

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Specifications

PubChem CID	119908
CAS	28267-29-0
Molecular Weight (g/mol)	242.403
MDL Number	MFCD00008978
SMILES	CCCCCCCCCCCCC(=O)OCC
Synonym	tridecanoic acid ethyl ester,tridecanoic acid, ethyl ester,ethyltridecanoate,ethyl=tridecanoate,tridecanoic acid, ethylester,acmc-1cr51,ethyl tridecanoate,n-tridecanoic acid ethyl ester
IUPAC Name	ethyl tridecanoate
InChI Key	QJYYMNOTJXIOBP-UHFFFAOYSA-N
Molecular Formula	C15H30O2

1,037

3,5,7-Trimethyladamantane-1-carboxylic acid, 97%, Thermo Scientific™

CAS: 15291-66-4 Molecular Formula: C14H22O2 Molecular Weight (g/mol): 222.33 MDL Number: MFCD00187581 InChI Key: DHIIUPVOLLOORM-UHFFFAOYSA-N Synonym: 3,5,8-trimethyladamantanecarboxylic acid,maybridge4_000576,1,3,5-trimethyladamantane-7-carboxylic acid,3,5,7-trimethyl adamantane-1-carboxylic acid,1s,3r,5s,7s-3,5,7-trimethyladamantane-1-carboxylic acid,3r,5s,7s-3,5,7-trimethyladamantane-1-carboxylic acid,tricyclo 3.3.1.13,7 decane-1-carboxylicacid, 3,5,7-trimethyl,tricyclo 3.3.1.1∼3,7∼ decane-1-carboxylic acid, 3,5,7-trimethyl PubChem CID: 2802268 IUPAC Name: 3,5,7-trimethyladamantane-1-carboxylic acid SMILES: CC12CC3(C)CC(C)(C1)CC(C2)(C3)C(O)=O

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Specifications

PubChem CID	2802268
CAS	15291-66-4
Molecular Weight (g/mol)	222.33
MDL Number	MFCD00187581
SMILES	CC12CC3(C)CC(C)(C1)CC(C2)(C3)C(O)=O
Synonym	3,5,8-trimethyladamantanecarboxylic acid,maybridge4_000576,1,3,5-trimethyladamantane-7-carboxylic acid,3,5,7-trimethyl adamantane-1-carboxylic acid,1s,3r,5s,7s-3,5,7-trimethyladamantane-1-carboxylic acid,3r,5s,7s-3,5,7-trimethyladamantane-1-carboxylic acid,tricyclo 3.3.1.13,7 decane-1-carboxylicacid, 3,5,7-trimethyl,tricyclo 3.3.1.1∼3,7∼ decane-1-carboxylic acid, 3,5,7-trimethyl
IUPAC Name	3,5,7-trimethyladamantane-1-carboxylic acid
InChI Key	DHIIUPVOLLOORM-UHFFFAOYSA-N
Molecular Formula	C14H22O2

1,038

L-Ascorbic acid, ≥99%, MP Biomedicals™

CAS: 134-03-2 Molecular Formula: C6H7NaO6 Molecular Weight (g/mol): 198.11 InChI Key: IFVCRSPJFHGFCG-HXPAKLQESA-N Synonym: sodium ascorbate,l-ascorbic acid sodium salt,sodium l-ascorbate,vitamin c sodium,ascorbicin,sodascorbate,cebitate,aminofenitrooxon,natrii ascorbas,monosodium l-ascorbate PubChem CID: 131674100 IUPAC Name: sodium 5-[(1S)-1,2-dihydroxyethyl]-3-hydroxy-2,4-dioxooxolan-3-ide SMILES: [Na+].OC[C@H](O)C1OC(=O)[C-](O)C1=O

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Specifications

PubChem CID	131674100
CAS	134-03-2
Molecular Weight (g/mol)	198.11
SMILES	[Na+].OC[C@H](O)C1OC(=O)[C-](O)C1=O
Synonym	sodium ascorbate,l-ascorbic acid sodium salt,sodium l-ascorbate,vitamin c sodium,ascorbicin,sodascorbate,cebitate,aminofenitrooxon,natrii ascorbas,monosodium l-ascorbate
IUPAC Name	sodium 5-[(1S)-1,2-dihydroxyethyl]-3-hydroxy-2,4-dioxooxolan-3-ide
InChI Key	IFVCRSPJFHGFCG-HXPAKLQESA-N
Molecular Formula	C6H7NaO6

1,039

1H-Benzimidazole-4-carboxylic acid, 97%

CAS: 46006-36-4 Molecular Formula: C8H6N2O2 Molecular Weight (g/mol): 162.15 MDL Number: MFCD01823426 InChI Key: VVQNAFBGAWCMLU-UHFFFAOYSA-N Synonym: 1h-benzoimidazole-4-carboxylic acid,1h-benzimidazole-7-carboxylic acid,benzimidazole-4-carboxylic acid,1h-benzo d imidazole-4-carboxylic acid,1h-1,3-benzodiazole-4-carboxylic acid,1h-benzo d imidazole-7-carboxylic acid,3h-1,3-benzodiazole-4-carboxylic acid,1h-benzimidazole-4-carboxylicacid,acmc-1aqhf,4-carboxy-1h-benzimidazole PubChem CID: 2771758 SMILES: OC(=O)C1=C2N=CNC2=CC=C1

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Specifications

PubChem CID	2771758
CAS	46006-36-4
Molecular Weight (g/mol)	162.15
MDL Number	MFCD01823426
SMILES	OC(=O)C1=C2N=CNC2=CC=C1
Synonym	1h-benzoimidazole-4-carboxylic acid,1h-benzimidazole-7-carboxylic acid,benzimidazole-4-carboxylic acid,1h-benzo d imidazole-4-carboxylic acid,1h-1,3-benzodiazole-4-carboxylic acid,1h-benzo d imidazole-7-carboxylic acid,3h-1,3-benzodiazole-4-carboxylic acid,1h-benzimidazole-4-carboxylicacid,acmc-1aqhf,4-carboxy-1h-benzimidazole
InChI Key	VVQNAFBGAWCMLU-UHFFFAOYSA-N
Molecular Formula	C8H6N2O2

1,040

5-Amino-1-methyl-1H-pyrazole-4-carboxamide, Thermo Scientific™

CAS: 18213-75-7 Molecular Formula: C5H8N4O Molecular Weight (g/mol): 140.146 MDL Number: MFCD00111808 InChI Key: JGSQVTVXGXOSCH-UHFFFAOYSA-N PubChem CID: 265696 IUPAC Name: 5-amino-1-methylpyrazole-4-carboxamide SMILES: CN1C(=C(C=N1)C(=O)N)N

Pricing & Availability
Specifications

PubChem CID	265696
CAS	18213-75-7
Molecular Weight (g/mol)	140.146
MDL Number	MFCD00111808
SMILES	CN1C(=C(C=N1)C(=O)N)N
IUPAC Name	5-amino-1-methylpyrazole-4-carboxamide
InChI Key	JGSQVTVXGXOSCH-UHFFFAOYSA-N
Molecular Formula	C5H8N4O

1,041

Ethyl 4-acetylbutyrate, 97%

CAS: 13984-57-1 Molecular Formula: C8H14O3 Molecular Weight (g/mol): 158.197 MDL Number: MFCD00009213 InChI Key: MGPSIDGTLFKDEY-UHFFFAOYSA-N Synonym: ethyl 4-acetylbutyrate,hexanoic acid, 5-oxo-, ethyl ester,5-oxohexanoic acid ethyl ester,ethyl 4-acetylbutanoate,ethyl 4-acetyl-butanoate,ethyl 4-acetyl-butyrate,acmc-1c2gr,5-oxo-hexanoic acid ethyl ester,mgpsidgtlfkdey-uhfffaoysa PubChem CID: 84130 IUPAC Name: ethyl 5-oxohexanoate SMILES: CCOC(=O)CCCC(=O)C

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Specifications

PubChem CID	84130
CAS	13984-57-1
Molecular Weight (g/mol)	158.197
MDL Number	MFCD00009213
SMILES	CCOC(=O)CCCC(=O)C
Synonym	ethyl 4-acetylbutyrate,hexanoic acid, 5-oxo-, ethyl ester,5-oxohexanoic acid ethyl ester,ethyl 4-acetylbutanoate,ethyl 4-acetyl-butanoate,ethyl 4-acetyl-butyrate,acmc-1c2gr,5-oxo-hexanoic acid ethyl ester,mgpsidgtlfkdey-uhfffaoysa
IUPAC Name	ethyl 5-oxohexanoate
InChI Key	MGPSIDGTLFKDEY-UHFFFAOYSA-N
Molecular Formula	C8H14O3

1,042

Dimethyl maleate, 96%

CAS: 624-48-6 Molecular Formula: C6H8O4 Molecular Weight (g/mol): 144.126 MDL Number: MFCD00008459 InChI Key: LDCRTTXIJACKKU-ARJAWSKDSA-N Synonym: dimethyl maleate,maleic acid, dimethyl ester,methyl maleate,sipomer dmm,maleic acid dimethyl ester,dimethyl cis-butenedioate,2-butenedioic acid z-, dimethyl ester,dimethyl cis-ethylenedicarboxylate,2-butenedioic acid 2z-, dimethyl ester,2-butenedioic acid, dimethyl ester, z PubChem CID: 5271565 ChEBI: CHEBI:35460 IUPAC Name: dimethyl (Z)-but-2-enedioate SMILES: COC(=O)C=CC(=O)OC

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Specifications

PubChem CID	5271565
CAS	624-48-6
Molecular Weight (g/mol)	144.126
ChEBI	CHEBI:35460
MDL Number	MFCD00008459
SMILES	COC(=O)C=CC(=O)OC
Synonym	dimethyl maleate,maleic acid, dimethyl ester,methyl maleate,sipomer dmm,maleic acid dimethyl ester,dimethyl cis-butenedioate,2-butenedioic acid z-, dimethyl ester,dimethyl cis-ethylenedicarboxylate,2-butenedioic acid 2z-, dimethyl ester,2-butenedioic acid, dimethyl ester, z
IUPAC Name	dimethyl (Z)-but-2-enedioate
InChI Key	LDCRTTXIJACKKU-ARJAWSKDSA-N
Molecular Formula	C6H8O4

1,043

1H-Benzimidazole-5-carboxylic acid, 98%

CAS: 15788-16-6 Molecular Formula: C8H6N2O2 Molecular Weight (g/mol): 162.15 MDL Number: MFCD00011555 InChI Key: COYPLDIXZODDDL-UHFFFAOYSA-N Synonym: 1h-benzimidazole-5-carboxylic acid,5-benzimidazolecarboxylic acid,benzimidazole-5-carboxylic acid,1h-benzo d imidazole-5-carboxylic acid,1h-benzimidazole-6-carboxylic acid,5-carboxybenzimidazole,1h-1,3-benzodiazole-5-carboxylic acid,3h-benzo d imidazole-5-carboxylic acid,1h-benzimidazole-5-carboxylicacid,1h-1,3-benzodiazole-6-carboxylic acid PubChem CID: 459456 IUPAC Name: 3H-benzimidazole-5-carboxylic acid SMILES: OC(=O)C1=CC=C2N=CNC2=C1

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Specifications

PubChem CID	459456
CAS	15788-16-6
Molecular Weight (g/mol)	162.15
MDL Number	MFCD00011555
SMILES	OC(=O)C1=CC=C2N=CNC2=C1
Synonym	1h-benzimidazole-5-carboxylic acid,5-benzimidazolecarboxylic acid,benzimidazole-5-carboxylic acid,1h-benzo d imidazole-5-carboxylic acid,1h-benzimidazole-6-carboxylic acid,5-carboxybenzimidazole,1h-1,3-benzodiazole-5-carboxylic acid,3h-benzo d imidazole-5-carboxylic acid,1h-benzimidazole-5-carboxylicacid,1h-1,3-benzodiazole-6-carboxylic acid
IUPAC Name	3H-benzimidazole-5-carboxylic acid
InChI Key	COYPLDIXZODDDL-UHFFFAOYSA-N
Molecular Formula	C8H6N2O2

1,044

Calcium propionate, 98+%

CAS: 4075-81-4 Molecular Formula: C6H10CaO4 Molecular Weight (g/mol): 186.22 MDL Number: MFCD00167354 InChI Key: BCZXFFBUYPCTSJ-UHFFFAOYSA-L Synonym: calcium propionate,calcium dipropionate,calcium propanoate,mycoban,propanoic acid, calcium salt,bioban-c,caswell no. 151,propionic acid, calcium salt,unii-8ai80040kw,hsdb 907 PubChem CID: 19999 ChEBI: CHEBI:81716 IUPAC Name: calcium;propanoate SMILES: [Ca++].CCC([O-])=O.CCC([O-])=O

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Specifications

PubChem CID	19999
CAS	4075-81-4
Molecular Weight (g/mol)	186.22
ChEBI	CHEBI:81716
MDL Number	MFCD00167354
SMILES	[Ca++].CCC([O-])=O.CCC([O-])=O
Synonym	calcium propionate,calcium dipropionate,calcium propanoate,mycoban,propanoic acid, calcium salt,bioban-c,caswell no. 151,propionic acid, calcium salt,unii-8ai80040kw,hsdb 907
IUPAC Name	calcium;propanoate
InChI Key	BCZXFFBUYPCTSJ-UHFFFAOYSA-L
Molecular Formula	C6H10CaO4

1,045

Methyl 3-methoxythiophene-2-carboxylate, 97%

CAS: 62353-75-7 Molecular Formula: C7H8O3S Molecular Weight (g/mol): 172.20 MDL Number: MFCD00102115 InChI Key: MWADWXJPBMFRGL-UHFFFAOYSA-N Synonym: 3-methoxy-2-thiophenecarboxylic acid methyl ester,acmc-20abea,methyl 3-methoxythiophene carboxylate,methyl 3-methoxy-2-thiophenecarboxylate,2-thiophenecarboxylicacid,3-methoxy-,methyl ester,3-methoxythiophene-2-carboxylic acid methyl ester PubChem CID: 701637 IUPAC Name: methyl 3-methoxythiophene-2-carboxylate SMILES: COC(=O)C1=C(OC)C=CS1

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Specifications

PubChem CID	701637
CAS	62353-75-7
Molecular Weight (g/mol)	172.20
MDL Number	MFCD00102115
SMILES	COC(=O)C1=C(OC)C=CS1
Synonym	3-methoxy-2-thiophenecarboxylic acid methyl ester,acmc-20abea,methyl 3-methoxythiophene carboxylate,methyl 3-methoxy-2-thiophenecarboxylate,2-thiophenecarboxylicacid,3-methoxy-,methyl ester,3-methoxythiophene-2-carboxylic acid methyl ester
IUPAC Name	methyl 3-methoxythiophene-2-carboxylate
InChI Key	MWADWXJPBMFRGL-UHFFFAOYSA-N
Molecular Formula	C7H8O3S

1,046

Zinc propionate, 97%

CAS: 557-28-8 Molecular Formula: C6H10O4Zn Molecular Weight (g/mol): 211.52 MDL Number: MFCD00045937 InChI Key: XDWXRAYGALQIFG-UHFFFAOYSA-L Synonym: zinc propionate,unii-81pxa87xvc,81pxa87xvc,propanoic acid, zinc salt 2:1,gyna-plex,propionic acid, zinc salt,zinc dipropionate,propanoic acid, zinc salt,zinc propanoate,propanoic acid, zinc salt, basic PubChem CID: 11189 IUPAC Name: zinc;propanoate SMILES: [Zn++].CCC([O-])=O.CCC([O-])=O

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Specifications

PubChem CID	11189
CAS	557-28-8
Molecular Weight (g/mol)	211.52
MDL Number	MFCD00045937
SMILES	[Zn++].CCC([O-])=O.CCC([O-])=O
Synonym	zinc propionate,unii-81pxa87xvc,81pxa87xvc,propanoic acid, zinc salt 2:1,gyna-plex,propionic acid, zinc salt,zinc dipropionate,propanoic acid, zinc salt,zinc propanoate,propanoic acid, zinc salt, basic
IUPAC Name	zinc;propanoate
InChI Key	XDWXRAYGALQIFG-UHFFFAOYSA-L
Molecular Formula	C6H10O4Zn

1,047

4-Pyridazinecarboxylic acid, 95%

CAS: 50681-25-9 Molecular Formula: C₅H₄N₂O₂ Molecular Weight (g/mol): 124.1 InChI Key: JUSIWJONLKBPDU-UHFFFAOYSA-N Synonym: 4-pyridazinecarboxylic acid,4-carboxypyridazine,4-pyridazinecarboxylicacid,pubchem9501,acmc-1alr8,pyridazin-4-carboxylic acid,4-pyridazine-carboxylic acid,ksc269i2f,pyridazin-4-yl formate,1,2-diazine-4-carboxylic acid PubChem CID: 2761046 IUPAC Name: pyridazine-4-carboxylic acid SMILES: C1=CN=NC=C1C(=O)O

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Specifications

PubChem CID	2761046
CAS	50681-25-9
Molecular Weight (g/mol)	124.1
SMILES	C1=CN=NC=C1C(=O)O
Synonym	4-pyridazinecarboxylic acid,4-carboxypyridazine,4-pyridazinecarboxylicacid,pubchem9501,acmc-1alr8,pyridazin-4-carboxylic acid,4-pyridazine-carboxylic acid,ksc269i2f,pyridazin-4-yl formate,1,2-diazine-4-carboxylic acid
IUPAC Name	pyridazine-4-carboxylic acid
InChI Key	JUSIWJONLKBPDU-UHFFFAOYSA-N
Molecular Formula	C₅H₄N₂O₂

1,048

1-Acetylpiperazine, 98%

CAS: 13889-98-0 Molecular Formula: C₆H₁₂N₂O Molecular Weight (g/mol): 128.17 MDL Number: MFCD00058676 InChI Key: PKDPUENCROCRCH-UHFFFAOYSA-N Synonym: 1-acetylpiperazine,n-acetylpiperazine,1-piperazin-1-yl ethanone,1-piperazin-1-yl ethan-1-one,n-acetyl piperazine,acetylpiperazine,1-acetyl piperazine,piperazine, 1-acetyl,1-piperazin-1-yl-ethanone,1-piperazin-1-yl ethanon PubChem CID: 83795 IUPAC Name: 1-piperazin-1-ylethanone SMILES: CC(=O)N1CCNCC1

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Specifications

PubChem CID	83795
CAS	13889-98-0
Molecular Weight (g/mol)	128.17
MDL Number	MFCD00058676
SMILES	CC(=O)N1CCNCC1
Synonym	1-acetylpiperazine,n-acetylpiperazine,1-piperazin-1-yl ethanone,1-piperazin-1-yl ethan-1-one,n-acetyl piperazine,acetylpiperazine,1-acetyl piperazine,piperazine, 1-acetyl,1-piperazin-1-yl-ethanone,1-piperazin-1-yl ethanon
IUPAC Name	1-piperazin-1-ylethanone
InChI Key	PKDPUENCROCRCH-UHFFFAOYSA-N
Molecular Formula	C₆H₁₂N₂O

1,049

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

1,050

2-(Dimethylcarbamoyl)benzeneboronic acid, 95%

CAS: 874219-16-6 Molecular Formula: C9H12BNO3 Molecular Weight (g/mol): 193.009 MDL Number: MFCD03425959 InChI Key: NZIOVLXULSCCSG-UHFFFAOYSA-N Synonym: 2-dimethylcarbamoyl phenyl boronic acid,2-n,n-dimethylaminocarbonyl phenylboronic acid,2-dimethylcarbamoyl phenylboronic acid,2-dimethylaminocarbonyl benzeneboronic acid,boronic acid,b-2-dimethylamino carbonyl phenyl,2-dimethylcarbamoyl benzeneboronic acid,acmc-209qkh,2-n,n-dimethylaminocarbonyl benzeneboronic acid,2-dimethylcarbamoyl phenyl boronicacid PubChem CID: 44119823 IUPAC Name: [2-(dimethylcarbamoyl)phenyl]boronic acid SMILES: B(C1=CC=CC=C1C(=O)N(C)C)(O)O

Pricing & Availability
Specifications

PubChem CID	44119823
CAS	874219-16-6
Molecular Weight (g/mol)	193.009
MDL Number	MFCD03425959
SMILES	B(C1=CC=CC=C1C(=O)N(C)C)(O)O
Synonym	2-dimethylcarbamoyl phenyl boronic acid,2-n,n-dimethylaminocarbonyl phenylboronic acid,2-dimethylcarbamoyl phenylboronic acid,2-dimethylaminocarbonyl benzeneboronic acid,boronic acid,b-2-dimethylamino carbonyl phenyl,2-dimethylcarbamoyl benzeneboronic acid,acmc-209qkh,2-n,n-dimethylaminocarbonyl benzeneboronic acid,2-dimethylcarbamoyl phenyl boronicacid
IUPAC Name	[2-(dimethylcarbamoyl)phenyl]boronic acid
InChI Key	NZIOVLXULSCCSG-UHFFFAOYSA-N
Molecular Formula	C9H12BNO3

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