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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.
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2,986 – 3,000 of 22,277 results
2,986

Ethyl 2-Bromovalerate 98.0+%, TCI America™

CAS: 615-83-8 Molecular Formula: C7H13BrO2 Molecular Weight (g/mol): 209.083 MDL Number: MFCD00000159 InChI Key: ORSIRXYHFPHWTN-UHFFFAOYSA-N PubChem CID: 79071 IUPAC Name: ethyl 2-bromopentanoate SMILES: CCCC(C(=O)OCC)Br

PubChem CID 79071
CAS 615-83-8
Molecular Weight (g/mol) 209.083
MDL Number MFCD00000159
SMILES CCCC(C(=O)OCC)Br
IUPAC Name ethyl 2-bromopentanoate
InChI Key ORSIRXYHFPHWTN-UHFFFAOYSA-N
Molecular Formula C7H13BrO2
2,987

Butyl Cyanoacetate 98.0+%, TCI America™

CAS: 5459-58-5 Molecular Formula: C7H11NO2 Molecular Weight (g/mol): 141.17 MDL Number: MFCD00001941 InChI Key: DJACTCNGCHPGOI-UHFFFAOYSA-N Synonym: butyl cyanoacetate,n-butyl cyanoacetate,acetic acid, cyano-, butyl ester,unii-f9h6l20voh,cyanoacetic acid butyl ester,cyanoacetic acid n-butyl ester,acetic acid, 2-cyano-, butyl ester,f9h6l20voh,butyl 2-cyanoethanoate,acmc-209lho PubChem CID: 79571 IUPAC Name: butyl 2-cyanoacetate SMILES: CCCCOC(=O)CC#N

PubChem CID 79571
CAS 5459-58-5
Molecular Weight (g/mol) 141.17
MDL Number MFCD00001941
SMILES CCCCOC(=O)CC#N
Synonym butyl cyanoacetate,n-butyl cyanoacetate,acetic acid, cyano-, butyl ester,unii-f9h6l20voh,cyanoacetic acid butyl ester,cyanoacetic acid n-butyl ester,acetic acid, 2-cyano-, butyl ester,f9h6l20voh,butyl 2-cyanoethanoate,acmc-209lho
IUPAC Name butyl 2-cyanoacetate
InChI Key DJACTCNGCHPGOI-UHFFFAOYSA-N
Molecular Formula C7H11NO2
2,988

Diisopropylamine Dichloroacetate 98.0+%, TCI America™

CAS: 660-27-5 Molecular Formula: C8H17Cl2NO2 Molecular Weight (g/mol): 230.13 MDL Number: MFCD00868288 InChI Key: ILKBHIBYKSHTKQ-UHFFFAOYSA-N Synonym: diisopropylamine dichloroacetate,diisopropylammonium dichloroacetate,diisopropylamine 2,2-dichloroacetate,vasculopatina,dipromonium,cubisol,dapocel,disotat,kalodil,oxypangam PubChem CID: 12617 IUPAC Name: 2,2-dichloroacetic acid; bis(propan-2-yl)amine SMILES: OC(=O)C(Cl)Cl.CC(C)NC(C)C

PubChem CID 12617
CAS 660-27-5
Molecular Weight (g/mol) 230.13
MDL Number MFCD00868288
SMILES OC(=O)C(Cl)Cl.CC(C)NC(C)C
Synonym diisopropylamine dichloroacetate,diisopropylammonium dichloroacetate,diisopropylamine 2,2-dichloroacetate,vasculopatina,dipromonium,cubisol,dapocel,disotat,kalodil,oxypangam
IUPAC Name 2,2-dichloroacetic acid; bis(propan-2-yl)amine
InChI Key ILKBHIBYKSHTKQ-UHFFFAOYSA-N
Molecular Formula C8H17Cl2NO2
2,989

Sodium 3-Chloro-2-hydroxypropanesulfonate 95.0+%, TCI America™

CAS: 126-83-0 Molecular Formula: C3H6ClNaO4S Molecular Weight (g/mol): 196.577 MDL Number: MFCD00013378 InChI Key: TZLNJNUWVOGZJU-UHFFFAOYSA-M Synonym: 3-Chloro-2-hydroxypropanesulfonic Acid Sodium Salt PubChem CID: 23662382 IUPAC Name: sodium;3-chloro-2-hydroxypropane-1-sulfonate SMILES: C(C(CCl)O)S(=O)(=O)[O-].[Na+]

PubChem CID 23662382
CAS 126-83-0
Molecular Weight (g/mol) 196.577
MDL Number MFCD00013378
SMILES C(C(CCl)O)S(=O)(=O)[O-].[Na+]
Synonym 3-Chloro-2-hydroxypropanesulfonic Acid Sodium Salt
IUPAC Name sodium;3-chloro-2-hydroxypropane-1-sulfonate
InChI Key TZLNJNUWVOGZJU-UHFFFAOYSA-M
Molecular Formula C3H6ClNaO4S
2,990

N-(1,1,3,3-Tetramethylbutyl)formamide 98.0+%, TCI America™

CAS: 10151-02-7 Molecular Formula: C9H19NO Molecular Weight (g/mol): 157.26 MDL Number: MFCD00039569 InChI Key: NBXAPOVFSGOATB-UHFFFAOYSA-N Synonym: N-Formyl-tert-octylamine, N-Formyl-1,1,3,3-tetramethylbutylamine, tert-Octylformamide PubChem CID: 82410 IUPAC Name: N-(2,4,4-trimethylpentan-2-yl)formamide SMILES: CC(C)(C)CC(C)(C)NC=O

PubChem CID 82410
CAS 10151-02-7
Molecular Weight (g/mol) 157.26
MDL Number MFCD00039569
SMILES CC(C)(C)CC(C)(C)NC=O
Synonym N-Formyl-tert-octylamine, N-Formyl-1,1,3,3-tetramethylbutylamine, tert-Octylformamide
IUPAC Name N-(2,4,4-trimethylpentan-2-yl)formamide
InChI Key NBXAPOVFSGOATB-UHFFFAOYSA-N
Molecular Formula C9H19NO
2,991

Capecitabine 98.0+%, TCI America™

CAS: 154361-50-9 Molecular Formula: C15H22FN3O6 Molecular Weight (g/mol): 359.354 MDL Number: MFCD00930626 InChI Key: GAGWJHPBXLXJQN-UORFTKCHSA-N Synonym: capecitabine,xeloda,capiibine,capecitibine,caxeta,xabine,capecitabine usan,capecitabina,capecitabinum,capecitabin PubChem CID: 60953 ChEBI: CHEBI:31348 IUPAC Name: pentyl N-[1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-methyloxolan-2-yl]-5-fluoro-2-oxopyrimidin-4-yl]carbamate SMILES: CCCCCOC(=O)NC1=NC(=O)N(C=C1F)C2C(C(C(O2)C)O)O

PubChem CID 60953
CAS 154361-50-9
Molecular Weight (g/mol) 359.354
ChEBI CHEBI:31348
MDL Number MFCD00930626
SMILES CCCCCOC(=O)NC1=NC(=O)N(C=C1F)C2C(C(C(O2)C)O)O
Synonym capecitabine,xeloda,capiibine,capecitibine,caxeta,xabine,capecitabine usan,capecitabina,capecitabinum,capecitabin
IUPAC Name pentyl N-[1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-methyloxolan-2-yl]-5-fluoro-2-oxopyrimidin-4-yl]carbamate
InChI Key GAGWJHPBXLXJQN-UORFTKCHSA-N
Molecular Formula C15H22FN3O6
2,992

Methyl Dimethoxyacetate 95.0+%, TCI America™

CAS: 89-91-8 Molecular Formula: C5H10O4 Molecular Weight (g/mol): 134.131 MDL Number: MFCD00008484 InChI Key: NZTCVGHPDWAALP-UHFFFAOYSA-N Synonym: methyl dimethoxyacetate,acetic acid, dimethoxy-, methyl ester,dimethoxyacetic acid methyl ester,glyoxylic acid methyl ester dimethyl acetal,acetic acid, 2,2-dimethoxy-, methyl ester,glyoxylic acid, methyl ester, 2-dimethyl acetal,zlchem 519,acmc-209r3k,ksc490c4f,methyl 2,2-dimethoxyethanoate PubChem CID: 66647 IUPAC Name: methyl 2,2-dimethoxyacetate SMILES: COC(C(=O)OC)OC

PubChem CID 66647
CAS 89-91-8
Molecular Weight (g/mol) 134.131
MDL Number MFCD00008484
SMILES COC(C(=O)OC)OC
Synonym methyl dimethoxyacetate,acetic acid, dimethoxy-, methyl ester,dimethoxyacetic acid methyl ester,glyoxylic acid methyl ester dimethyl acetal,acetic acid, 2,2-dimethoxy-, methyl ester,glyoxylic acid, methyl ester, 2-dimethyl acetal,zlchem 519,acmc-209r3k,ksc490c4f,methyl 2,2-dimethoxyethanoate
IUPAC Name methyl 2,2-dimethoxyacetate
InChI Key NZTCVGHPDWAALP-UHFFFAOYSA-N
Molecular Formula C5H10O4
2,993

2-Cyanoethyl Acrylate (stabilized with MEHQ) 95.0+%, TCI America™

CAS: 106-71-8 Molecular Formula: C6H7NO2 Molecular Weight (g/mol): 125.13 MDL Number: MFCD00013823 InChI Key: AEPWOCLBLLCOGZ-UHFFFAOYSA-N Synonym: Acrylic Acid 2-Cyanoethyl Ester, 3-Acryloyloxypropionitrile PubChem CID: 7825 IUPAC Name: 2-cyanoethyl prop-2-enoate SMILES: C=CC(=O)OCCC#N

PubChem CID 7825
CAS 106-71-8
Molecular Weight (g/mol) 125.13
MDL Number MFCD00013823
SMILES C=CC(=O)OCCC#N
Synonym Acrylic Acid 2-Cyanoethyl Ester, 3-Acryloyloxypropionitrile
IUPAC Name 2-cyanoethyl prop-2-enoate
InChI Key AEPWOCLBLLCOGZ-UHFFFAOYSA-N
Molecular Formula C6H7NO2
2,994

Tetraethylene Glycol Diacrylate (stabilized with MEHQ) 90.0+%, TCI America™

CAS: 17831-71-9 Molecular Formula: C14H22O7 Molecular Weight (g/mol): 302.323 MDL Number: MFCD00008630 InChI Key: HCLJOFJIQIJXHS-UHFFFAOYSA-N PubChem CID: 28803 IUPAC Name: 2-[2-[2-(2-prop-2-enoyloxyethoxy)ethoxy]ethoxy]ethyl prop-2-enoate SMILES: C=CC(=O)OCCOCCOCCOCCOC(=O)C=C

PubChem CID 28803
CAS 17831-71-9
Molecular Weight (g/mol) 302.323
MDL Number MFCD00008630
SMILES C=CC(=O)OCCOCCOCCOCCOC(=O)C=C
IUPAC Name 2-[2-[2-(2-prop-2-enoyloxyethoxy)ethoxy]ethoxy]ethyl prop-2-enoate
InChI Key HCLJOFJIQIJXHS-UHFFFAOYSA-N
Molecular Formula C14H22O7
2,995

tert-Butyl Acetate 99.0+%, TCI America™

CAS: 540-88-5 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00008807 InChI Key: WMOVHXAZOJBABW-UHFFFAOYSA-N Synonym: t-butyl acetate,acetic acid tert-butyl ester,tert-butyl ethanoate,acetic acid, 1,1-dimethylethyl ester,texaco lead appreciator,acetic acid, tert-butyl ester,tert-butylacetate,tert butyl acetate,1,1-dimethylethyl acetate,1,1-dimethyl acetate PubChem CID: 10908 IUPAC Name: tert-butyl acetate SMILES: CC(=O)OC(C)(C)C

PubChem CID 10908
CAS 540-88-5
Molecular Weight (g/mol) 116.16
MDL Number MFCD00008807
SMILES CC(=O)OC(C)(C)C
Synonym t-butyl acetate,acetic acid tert-butyl ester,tert-butyl ethanoate,acetic acid, 1,1-dimethylethyl ester,texaco lead appreciator,acetic acid, tert-butyl ester,tert-butylacetate,tert butyl acetate,1,1-dimethylethyl acetate,1,1-dimethyl acetate
IUPAC Name tert-butyl acetate
InChI Key WMOVHXAZOJBABW-UHFFFAOYSA-N
Molecular Formula C6H12O2
2,996

2-Ethyl-4-hydroxy-5-methyl-3(2H)-furanone 97.0+%, TCI America™

CAS: 27538-10-9 Molecular Formula: C7H10O3 Molecular Weight (g/mol): 142.15 MDL Number: MFCD00191360 InChI Key: GWCRPYGYVRXVLI-UHFFFAOYNA-N PubChem CID: 33931 IUPAC Name: 2-ethyl-4-hydroxy-5-methyl-2,3-dihydrofuran-3-one SMILES: CCC1OC(C)=C(O)C1=O

PubChem CID 33931
CAS 27538-10-9
Molecular Weight (g/mol) 142.15
MDL Number MFCD00191360
SMILES CCC1OC(C)=C(O)C1=O
IUPAC Name 2-ethyl-4-hydroxy-5-methyl-2,3-dihydrofuran-3-one
InChI Key GWCRPYGYVRXVLI-UHFFFAOYNA-N
Molecular Formula C7H10O3
2,997

Ethyl 3-Methylpyrazole-5-carboxylate 98.0+%, TCI America™

CAS: 4027-57-0 Molecular Formula: C7H10N2O2 Molecular Weight (g/mol): 154.17 MDL Number: MFCD00052514 InChI Key: BOTXQJAHRCGJEG-UHFFFAOYSA-N PubChem CID: 77645 IUPAC Name: ethyl 5-methyl-1H-pyrazole-3-carboxylate SMILES: CCOC(=O)C1=NNC(C)=C1

PubChem CID 77645
CAS 4027-57-0
Molecular Weight (g/mol) 154.17
MDL Number MFCD00052514
SMILES CCOC(=O)C1=NNC(C)=C1
IUPAC Name ethyl 5-methyl-1H-pyrazole-3-carboxylate
InChI Key BOTXQJAHRCGJEG-UHFFFAOYSA-N
Molecular Formula C7H10N2O2
2,998

Ethyl 3-Cyclopentene-1-carboxylate 97.0+%, TCI America™

CAS: 21622-01-5 Molecular Formula: C8H12O2 Molecular Weight (g/mol): 140.182 MDL Number: MFCD06410819 InChI Key: CTLAIKSGNQPPLO-UHFFFAOYSA-N Synonym: 3-Cyclopentene-1-carboxylic Acid Ethyl Ester PubChem CID: 5314991 IUPAC Name: ethyl cyclopent-3-ene-1-carboxylate SMILES: CCOC(=O)C1CC=CC1

PubChem CID 5314991
CAS 21622-01-5
Molecular Weight (g/mol) 140.182
MDL Number MFCD06410819
SMILES CCOC(=O)C1CC=CC1
Synonym 3-Cyclopentene-1-carboxylic Acid Ethyl Ester
IUPAC Name ethyl cyclopent-3-ene-1-carboxylate
InChI Key CTLAIKSGNQPPLO-UHFFFAOYSA-N
Molecular Formula C8H12O2
2,999

Ethyl 3-Methylindole-2-carboxylate 98.0+%, TCI America™

CAS: 26304-51-8 Molecular Formula: C12H13NO2 Molecular Weight (g/mol): 203.241 MDL Number: MFCD00225365 InChI Key: OZQXZSIVKVCSDF-UHFFFAOYSA-N Synonym: 3-Methylindole-2-carboxylic Acid Ethyl Ester PubChem CID: 593963 IUPAC Name: ethyl 3-methyl-1H-indole-2-carboxylate SMILES: CCOC(=O)C1=C(C2=CC=CC=C2N1)C

PubChem CID 593963
CAS 26304-51-8
Molecular Weight (g/mol) 203.241
MDL Number MFCD00225365
SMILES CCOC(=O)C1=C(C2=CC=CC=C2N1)C
Synonym 3-Methylindole-2-carboxylic Acid Ethyl Ester
IUPAC Name ethyl 3-methyl-1H-indole-2-carboxylate
InChI Key OZQXZSIVKVCSDF-UHFFFAOYSA-N
Molecular Formula C12H13NO2
3,000

Ethyl 2,4-Dimethylpyrrole-3-carboxylate 98.0+%, TCI America™

CAS: 2199-51-1 Molecular Formula: C9H13NO2 Molecular Weight (g/mol): 167.208 MDL Number: MFCD01365811 InChI Key: QWSFDUPEOPMXCV-UHFFFAOYSA-N Synonym: 2,4-Dimethylpyrrole-3-carboxylic Acid Ethyl Ester PubChem CID: 137481 IUPAC Name: ethyl 2,4-dimethyl-1H-pyrrole-3-carboxylate SMILES: CCOC(=O)C1=C(NC=C1C)C

PubChem CID 137481
CAS 2199-51-1
Molecular Weight (g/mol) 167.208
MDL Number MFCD01365811
SMILES CCOC(=O)C1=C(NC=C1C)C
Synonym 2,4-Dimethylpyrrole-3-carboxylic Acid Ethyl Ester
IUPAC Name ethyl 2,4-dimethyl-1H-pyrrole-3-carboxylate
InChI Key QWSFDUPEOPMXCV-UHFFFAOYSA-N
Molecular Formula C9H13NO2