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Organic acids and derivatives

Organic compounds with acidic properties, and will commonly have carboxylic acids or similar functional groups in their structure. Derived compounds are also included.
Carboxylic acids and derivatives (11,885)
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2,236 – 2,250 of 22,281 results
2,236
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o-Tolylacetic acid, 99%

CAS: 644-36-0 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.177 MDL Number: MFCD00004328 InChI Key: RZWGTXHSYZGXKF-UHFFFAOYSA-N Synonym: o-tolylacetic acid,2-methylphenylacetic acid,2-methylphenyl acetic acid,2-2-methylphenyl acetic acid,2-o-tolyl acetic acid,2-tolylacetic acid,2-o-tolylacetic acid,o-methylphenylacetic acid,o-tolyacetic acid PubChem CID: 69519 IUPAC Name: 2-(2-methylphenyl)acetic acid SMILES: CC1=CC=CC=C1CC(=O)O

PubChem CID 69519
CAS 644-36-0
Molecular Weight (g/mol) 150.177
MDL Number MFCD00004328
SMILES CC1=CC=CC=C1CC(=O)O
Synonym o-tolylacetic acid,2-methylphenylacetic acid,2-methylphenyl acetic acid,2-2-methylphenyl acetic acid,2-o-tolyl acetic acid,2-tolylacetic acid,2-o-tolylacetic acid,o-methylphenylacetic acid,o-tolyacetic acid
IUPAC Name 2-(2-methylphenyl)acetic acid
InChI Key RZWGTXHSYZGXKF-UHFFFAOYSA-N
Molecular Formula C9H10O2
2,237
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Isovaleric acid, 99%

CAS: 503-74-2 Molecular Formula: C5H10O2 Molecular Weight (g/mol): 102.13 MDL Number: MFCD00002726 InChI Key: GWYFCOCPABKNJV-UHFFFAOYSA-N Synonym: isovaleric acid,isopentanoic acid,3-methylbutyric acid,delphinic acid,isopropylacetic acid,butanoic acid, 3-methyl,isovalerianic acid,isobutylformic acid,3-methylbutyrate,beta-methylbutyric acid PubChem CID: 10430 ChEBI: CHEBI:28484 IUPAC Name: 3-methylbutanoic acid SMILES: CC(C)CC(O)=O

PubChem CID 10430
CAS 503-74-2
Molecular Weight (g/mol) 102.13
ChEBI CHEBI:28484
MDL Number MFCD00002726
SMILES CC(C)CC(O)=O
Synonym isovaleric acid,isopentanoic acid,3-methylbutyric acid,delphinic acid,isopropylacetic acid,butanoic acid, 3-methyl,isovalerianic acid,isobutylformic acid,3-methylbutyrate,beta-methylbutyric acid
IUPAC Name 3-methylbutanoic acid
InChI Key GWYFCOCPABKNJV-UHFFFAOYSA-N
Molecular Formula C5H10O2
2,238
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Ethyl isovalerate, 98%

CAS: 108-64-5 Molecular Formula: C7H14O2 Molecular Weight (g/mol): 130.187 MDL Number: MFCD00009203 InChI Key: PPXUHEORWJQRHJ-UHFFFAOYSA-N Synonym: ethyl isovalerate,ethyl 3-methylbutyrate,ethylisovalerate,ethyl isopentanoate,isovaleric acid, ethyl ester,butanoic acid, 3-methyl-, ethyl ester,ethyl beta-methylbutyrate,ethyl isovalerianate,3-methylbutyric acid ethyl ester,3-methylbutanoic acid ethyl ester PubChem CID: 7945 ChEBI: CHEBI:31571 IUPAC Name: ethyl 3-methylbutanoate SMILES: CCOC(=O)CC(C)C

PubChem CID 7945
CAS 108-64-5
Molecular Weight (g/mol) 130.187
ChEBI CHEBI:31571
MDL Number MFCD00009203
SMILES CCOC(=O)CC(C)C
Synonym ethyl isovalerate,ethyl 3-methylbutyrate,ethylisovalerate,ethyl isopentanoate,isovaleric acid, ethyl ester,butanoic acid, 3-methyl-, ethyl ester,ethyl beta-methylbutyrate,ethyl isovalerianate,3-methylbutyric acid ethyl ester,3-methylbutanoic acid ethyl ester
IUPAC Name ethyl 3-methylbutanoate
InChI Key PPXUHEORWJQRHJ-UHFFFAOYSA-N
Molecular Formula C7H14O2
2,239
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4-Cyanophenylacetic acid, 97%

CAS: 5462-71-5 Molecular Formula: C9H7NO2 Molecular Weight (g/mol): 161.16 MDL Number: MFCD06798066 InChI Key: WEBXRQONNWEETE-UHFFFAOYSA-N Synonym: 2-4-cyanophenyl acetic acid,4-cyanophenylacetic acid,4-cyanophenyl acetic acid,benzeneacetic acid, 4-cyano,4-cyano-phenyl-acetic acid,p-cyanophenylacetic acid,4-cyanobenzeneacetic acid,p-cyanophenyl acetic acid,acetic acid, p-cyanophenyl PubChem CID: 79587 IUPAC Name: 2-(4-cyanophenyl)acetic acid SMILES: OC(=O)CC1=CC=C(C=C1)C#N

PubChem CID 79587
CAS 5462-71-5
Molecular Weight (g/mol) 161.16
MDL Number MFCD06798066
SMILES OC(=O)CC1=CC=C(C=C1)C#N
Synonym 2-4-cyanophenyl acetic acid,4-cyanophenylacetic acid,4-cyanophenyl acetic acid,benzeneacetic acid, 4-cyano,4-cyano-phenyl-acetic acid,p-cyanophenylacetic acid,4-cyanobenzeneacetic acid,p-cyanophenyl acetic acid,acetic acid, p-cyanophenyl
IUPAC Name 2-(4-cyanophenyl)acetic acid
InChI Key WEBXRQONNWEETE-UHFFFAOYSA-N
Molecular Formula C9H7NO2
2,240
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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

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
2,241
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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 SMILES: OC(=O)C1=CC=C2N=CNC2=C1

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
InChI Key COYPLDIXZODDDL-UHFFFAOYSA-N
Molecular Formula C8H6N2O2
2,242
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trans-2-Hexenyl acetate, 98%

CAS: 2497-18-9 Molecular Formula: C8H14O2 Molecular Weight (g/mol): 142.198 MDL Number: MFCD00009474 InChI Key: HRHOWZHRCRZVCU-AATRIKPKSA-N Synonym: z-hex-2-enyl acetate,unii-pt792bq57d,2-hexen-1-ol, acetate, z,z-2-hexenyl acetate,fema no. 2564,2-hexen-1-yl acetate, trans,2-hexen-1-ol, acetate, 2e,2-hexenyl acetate, trans,hexenyl acetate, 2z PubChem CID: 2733294 IUPAC Name: [(E)-hex-2-enyl] acetate SMILES: CCCC=CCOC(=O)C

PubChem CID 2733294
CAS 2497-18-9
Molecular Weight (g/mol) 142.198
MDL Number MFCD00009474
SMILES CCCC=CCOC(=O)C
Synonym z-hex-2-enyl acetate,unii-pt792bq57d,2-hexen-1-ol, acetate, z,z-2-hexenyl acetate,fema no. 2564,2-hexen-1-yl acetate, trans,2-hexen-1-ol, acetate, 2e,2-hexenyl acetate, trans,hexenyl acetate, 2z
IUPAC Name [(E)-hex-2-enyl] acetate
InChI Key HRHOWZHRCRZVCU-AATRIKPKSA-N
Molecular Formula C8H14O2
2,243
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Ethyl Oleate, NF, Spectrum™ Chemical
SDP

CAS: 111-62-6 Molecular Formula: C20H38O2 Molecular Weight (g/mol): 310.52 InChI Key: LVGKNOAMLMIIKO-VAWYXSNFSA-N IUPAC Name: ethyl (9E)-octadec-9-enoate SMILES: CCCCCCCC\C=C\CCCCCCCC(=O)OCC

CAS 111-62-6
Molecular Weight (g/mol) 310.52
SMILES CCCCCCCC\C=C\CCCCCCCC(=O)OCC
IUPAC Name ethyl (9E)-octadec-9-enoate
InChI Key LVGKNOAMLMIIKO-VAWYXSNFSA-N
Molecular Formula C20H38O2
2,244
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2-Propylpentanoic acid, 99%

CAS: 99-66-1 Molecular Formula: C8H16O2 Molecular Weight (g/mol): 144.21 MDL Number: MFCD00002672 InChI Key: NIJJYAXOARWZEE-UHFFFAOYSA-N Synonym: valproic acid,dipropylacetic acid,depakene,depakine,2-propylvaleric acid,ergenyl,di-n-propylacetic acid,valproate,mylproin,pentanoic acid, 2-propyl PubChem CID: 3121 ChEBI: CHEBI:39867 IUPAC Name: 2-propylpentanoic acid SMILES: CCCC(CCC)C(O)=O

PubChem CID 3121
CAS 99-66-1
Molecular Weight (g/mol) 144.21
ChEBI CHEBI:39867
MDL Number MFCD00002672
SMILES CCCC(CCC)C(O)=O
Synonym valproic acid,dipropylacetic acid,depakene,depakine,2-propylvaleric acid,ergenyl,di-n-propylacetic acid,valproate,mylproin,pentanoic acid, 2-propyl
IUPAC Name 2-propylpentanoic acid
InChI Key NIJJYAXOARWZEE-UHFFFAOYSA-N
Molecular Formula C8H16O2
2,245
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Cyclopropanecarboxylic acid, 98%

CAS: 1759-53-1 Molecular Formula: C4H6O2 Molecular Weight (g/mol): 86.09 MDL Number: MFCD00001287 InChI Key: YMGUBTXCNDTFJI-UHFFFAOYSA-N Synonym: carboxycyclopropane,cyclopropylcarboxylic acid,cyclopropionic acid,cyclopropane carboxylic acid,cyclopropanecarboxylicacid,cpc-acid,cyclopropyl carboxylic acid,trimethylenecarboxylic acid,cyclopropane carboylic acid,cyclopropane-carboxylic acid PubChem CID: 15655 ChEBI: CHEBI:23500 IUPAC Name: cyclopropanecarboxylic acid SMILES: C1CC1C(=O)O

PubChem CID 15655
CAS 1759-53-1
Molecular Weight (g/mol) 86.09
ChEBI CHEBI:23500
MDL Number MFCD00001287
SMILES C1CC1C(=O)O
Synonym carboxycyclopropane,cyclopropylcarboxylic acid,cyclopropionic acid,cyclopropane carboxylic acid,cyclopropanecarboxylicacid,cpc-acid,cyclopropyl carboxylic acid,trimethylenecarboxylic acid,cyclopropane carboylic acid,cyclopropane-carboxylic acid
IUPAC Name cyclopropanecarboxylic acid
InChI Key YMGUBTXCNDTFJI-UHFFFAOYSA-N
Molecular Formula C4H6O2
2,246

n-Butyl dodecanoate, 99+%

CAS: 106-18-3 Molecular Formula: C16H32O2 Molecular Weight (g/mol): 256.43 MDL Number: MFCD00042870 InChI Key: NDKYEUQMPZIGFN-UHFFFAOYSA-N Synonym: butyl laurate,dodecanoic acid, butyl ester,n-butyl laurate,bytyl laurate,butyl dodecylate,lauric acid butyl ester,lauric acid, butyl ester,lauric acid n-butyl ester,unii-23985ocm4h,n-butyl n-dodecanoate PubChem CID: 61015 IUPAC Name: butyl dodecanoate SMILES: CCCCCCCCCCCC(=O)OCCCC

PubChem CID 61015
CAS 106-18-3
Molecular Weight (g/mol) 256.43
MDL Number MFCD00042870
SMILES CCCCCCCCCCCC(=O)OCCCC
Synonym butyl laurate,dodecanoic acid, butyl ester,n-butyl laurate,bytyl laurate,butyl dodecylate,lauric acid butyl ester,lauric acid, butyl ester,lauric acid n-butyl ester,unii-23985ocm4h,n-butyl n-dodecanoate
IUPAC Name butyl dodecanoate
InChI Key NDKYEUQMPZIGFN-UHFFFAOYSA-N
Molecular Formula C16H32O2
2,247
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2-Cyclopentene-1-acetic acid, tech. 90%, remainder mainly 3-cyclopentene-1-acetic acid

CAS: 13668-61-6 Molecular Formula: C7H10O2 Molecular Weight (g/mol): 126.155 MDL Number: MFCD00001400 InChI Key: NNRZTJAACCRFRV-UHFFFAOYSA-N Synonym: 2-cyclopentene-1-acetic acid,2-cyclopent-2-en-1-yl acetic acid,cyclopent-2-enylacetic acid,2-cyclopenten-1-ylacetic acid,cyclopent-2-en-1-ylacetic acid,cyclopentene-3-acetic acid,2-cyclopentene-1-aceticacid,acmc-1c47k,2-cyclopent-2-enylacetic acid,cyclopent-2-ene-1-acetic acid PubChem CID: 96216 IUPAC Name: 2-cyclopent-2-en-1-ylacetic acid SMILES: C1CC(C=C1)CC(=O)O

PubChem CID 96216
CAS 13668-61-6
Molecular Weight (g/mol) 126.155
MDL Number MFCD00001400
SMILES C1CC(C=C1)CC(=O)O
Synonym 2-cyclopentene-1-acetic acid,2-cyclopent-2-en-1-yl acetic acid,cyclopent-2-enylacetic acid,2-cyclopenten-1-ylacetic acid,cyclopent-2-en-1-ylacetic acid,cyclopentene-3-acetic acid,2-cyclopentene-1-aceticacid,acmc-1c47k,2-cyclopent-2-enylacetic acid,cyclopent-2-ene-1-acetic acid
IUPAC Name 2-cyclopent-2-en-1-ylacetic acid
InChI Key NNRZTJAACCRFRV-UHFFFAOYSA-N
Molecular Formula C7H10O2
2,248
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3-Methylbenzo[b]thiophene-2-acetic acid, 97%

CAS: 1505-52-8 Molecular Formula: C11H10O2S Molecular Weight (g/mol): 206.259 MDL Number: MFCD00052299 InChI Key: MFVMWBIORCNCNB-UHFFFAOYSA-N Synonym: 2-3-methylbenzo b thiophen-2-yl acetic acid,benzo b thiophene-2-acetic acid, 3-methyl,3-methylbenzo b thiophene-2-acetic acid,3-methylthianaphthene-2-acetic acid,3-methyl-1-benzothiophen-2-yl acetic acid,2-3-methyl-1-benzothiophen-2-yl acetic acid,maybridge1_005368,3-methyl thianaphthene-2acetic acid,3-methylbenzo b-thiophene-2-acetic acid,benzo b thiophene-2-aceticacid,3-methyl PubChem CID: 2779867 IUPAC Name: 2-(3-methyl-1-benzothiophen-2-yl)acetic acid SMILES: CC1=C(SC2=CC=CC=C12)CC(=O)O

PubChem CID 2779867
CAS 1505-52-8
Molecular Weight (g/mol) 206.259
MDL Number MFCD00052299
SMILES CC1=C(SC2=CC=CC=C12)CC(=O)O
Synonym 2-3-methylbenzo b thiophen-2-yl acetic acid,benzo b thiophene-2-acetic acid, 3-methyl,3-methylbenzo b thiophene-2-acetic acid,3-methylthianaphthene-2-acetic acid,3-methyl-1-benzothiophen-2-yl acetic acid,2-3-methyl-1-benzothiophen-2-yl acetic acid,maybridge1_005368,3-methyl thianaphthene-2acetic acid,3-methylbenzo b-thiophene-2-acetic acid,benzo b thiophene-2-aceticacid,3-methyl
IUPAC Name 2-(3-methyl-1-benzothiophen-2-yl)acetic acid
InChI Key MFVMWBIORCNCNB-UHFFFAOYSA-N
Molecular Formula C11H10O2S
2,249
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1,3-Propane sultone, 97%

CAS: 1120-71-4 Molecular Formula: C3H6O3S Molecular Weight (g/mol): 122.14 MDL Number: MFCD00005355 InChI Key: FSSPGSAQUIYDCN-UHFFFAOYSA-N Synonym: 1,3-propanesultone,propane sultone,1,2-oxathiolane 2,2-dioxide,1,3-propane sultone,1,2-oxathiolane, 2,2-dioxide,propanesultone,rcra waste number u193,.gamma.-propane sultone,3-hydroxy-1-propanesulfonic acid gamma-sultone,unii-l6ntk7vjx9 PubChem CID: 14264 ChEBI: CHEBI:82370 IUPAC Name: oxathiolane 2,2-dioxide SMILES: O=S1(=O)CCCO1

PubChem CID 14264
CAS 1120-71-4
Molecular Weight (g/mol) 122.14
ChEBI CHEBI:82370
MDL Number MFCD00005355
SMILES O=S1(=O)CCCO1
Synonym 1,3-propanesultone,propane sultone,1,2-oxathiolane 2,2-dioxide,1,3-propane sultone,1,2-oxathiolane, 2,2-dioxide,propanesultone,rcra waste number u193,.gamma.-propane sultone,3-hydroxy-1-propanesulfonic acid gamma-sultone,unii-l6ntk7vjx9
IUPAC Name oxathiolane 2,2-dioxide
InChI Key FSSPGSAQUIYDCN-UHFFFAOYSA-N
Molecular Formula C3H6O3S
2,250
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Methyl trimethylacetate, 99%

CAS: 598-98-1 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00008843 InChI Key: CNMFHDIDIMZHKY-UHFFFAOYSA-N Synonym: methyl pivalate,methyl trimethylacetate,propanoic acid, 2,2-dimethyl-, methyl ester,pivalic acid, methyl ester,unii-bfx9w386ox,bfx9w386ox,pivalic acid methyl ester,methyl pivaloate,methyltrimethylacetate,tert-c4h9cooch3 PubChem CID: 69027 IUPAC Name: methyl 2,2-dimethylpropanoate SMILES: CC(C)(C)C(=O)OC

PubChem CID 69027
CAS 598-98-1
Molecular Weight (g/mol) 116.16
MDL Number MFCD00008843
SMILES CC(C)(C)C(=O)OC
Synonym methyl pivalate,methyl trimethylacetate,propanoic acid, 2,2-dimethyl-, methyl ester,pivalic acid, methyl ester,unii-bfx9w386ox,bfx9w386ox,pivalic acid methyl ester,methyl pivaloate,methyltrimethylacetate,tert-c4h9cooch3
IUPAC Name methyl 2,2-dimethylpropanoate
InChI Key CNMFHDIDIMZHKY-UHFFFAOYSA-N
Molecular Formula C6H12O2