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.

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436 – 450 of 2,269 results

436

Ethyl Butyrate 98.0+%, TCI America™

CAS: 105-54-4 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00009394 InChI Key: OBNCKNCVKJNDBV-UHFFFAOYSA-N Synonym: ethyl butyrate,butyric acid ethyl ester,ethyl n-butyrate,butanoic acid, ethyl ester,butyric ester,butyric ether,butyric acid, ethyl ester,ethyl n-butanoate,butanoic acid ethyl ester,fema number 2427 PubChem CID: 7762 IUPAC Name: ethyl butanoate SMILES: CCCC(=O)OCC

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PubChem CID	7762
CAS	105-54-4
Molecular Weight (g/mol)	116.16
MDL Number	MFCD00009394
SMILES	CCCC(=O)OCC
Synonym	ethyl butyrate,butyric acid ethyl ester,ethyl n-butyrate,butanoic acid, ethyl ester,butyric ester,butyric ether,butyric acid, ethyl ester,ethyl n-butanoate,butanoic acid ethyl ester,fema number 2427
IUPAC Name	ethyl butanoate
InChI Key	OBNCKNCVKJNDBV-UHFFFAOYSA-N
Molecular Formula	C6H12O2

437

Propyl Lactate 95.0+%, TCI America™

CAS: 616-09-1 Molecular Formula: C6H12O3 Molecular Weight (g/mol): 132.159 MDL Number: MFCD00059661 InChI Key: ILVGAIQLOCKNQA-UHFFFAOYSA-N Synonym: Lactic Acid Propyl Ester PubChem CID: 92821 IUPAC Name: propyl 2-hydroxypropanoate SMILES: CCCOC(=O)C(C)O

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Specifications

PubChem CID	92821
CAS	616-09-1
Molecular Weight (g/mol)	132.159
MDL Number	MFCD00059661
SMILES	CCCOC(=O)C(C)O
Synonym	Lactic Acid Propyl Ester
IUPAC Name	propyl 2-hydroxypropanoate
InChI Key	ILVGAIQLOCKNQA-UHFFFAOYSA-N
Molecular Formula	C6H12O3

438

Ethyl Cyanoacetate 99.0+%, TCI America™

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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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

439

Butyl Hexanoate 98.0+%, TCI America™

CAS: 626-82-4 Molecular Formula: C10H20O2 Molecular Weight (g/mol): 172.268 MDL Number: MFCD00053804 InChI Key: RPRPDTXKGSIXMD-UHFFFAOYSA-N Synonym: Hexanoic Acid Butyl Ester PubChem CID: 12294 IUPAC Name: butyl hexanoate SMILES: CCCCCC(=O)OCCCC

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Specifications

PubChem CID	12294
CAS	626-82-4
Molecular Weight (g/mol)	172.268
MDL Number	MFCD00053804
SMILES	CCCCCC(=O)OCCCC
Synonym	Hexanoic Acid Butyl Ester
IUPAC Name	butyl hexanoate
InChI Key	RPRPDTXKGSIXMD-UHFFFAOYSA-N
Molecular Formula	C10H20O2

440

(-)-Epicatechin Gallate 98.0+%, TCI America™

CAS: 1257-08-5 Molecular Formula: C22H18O10 Molecular Weight (g/mol): 442.376 MDL Number: MFCD00075936 InChI Key: LSHVYAFMTMFKBA-TZIWHRDSSA-N Synonym: =--epicatechin gallate,epicatechin gallate,=--epicatechin-3-o-gallate,l-epicatechin gallate,=--epicatechin-3-gallate,=--epicatechingallate,epicatechin monogallate,--epicatechin 3-o-gallate,teatannin,epicatechol, gallate PubChem CID: 107905 ChEBI: CHEBI:70255 IUPAC Name: [(2R,3R)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate SMILES: C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O

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Specifications

PubChem CID	107905
CAS	1257-08-5
Molecular Weight (g/mol)	442.376
ChEBI	CHEBI:70255
MDL Number	MFCD00075936
SMILES	C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O
Synonym	=--epicatechin gallate,epicatechin gallate,=--epicatechin-3-o-gallate,l-epicatechin gallate,=--epicatechin-3-gallate,=--epicatechingallate,epicatechin monogallate,--epicatechin 3-o-gallate,teatannin,epicatechol, gallate
IUPAC Name	[(2R,3R)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate
InChI Key	LSHVYAFMTMFKBA-TZIWHRDSSA-N
Molecular Formula	C22H18O10

441

Methyl Gallate 98.0+%, TCI America™

CAS: 99-24-1 Molecular Formula: C8H8O5 Molecular Weight (g/mol): 184.147 MDL Number: MFCD00002194 InChI Key: FBSFWRHWHYMIOG-UHFFFAOYSA-N Synonym: methyl gallate,gallic acid methyl ester,methylgallate,benzoic acid, 3,4,5-trihydroxy-, methyl ester,gallic acid, methyl ester,methyl galloate,unii-623d3xg80c,ccris 5567,3,4,5-trihydroxybenzoic acid methyl ester,chembl65675 PubChem CID: 7428 IUPAC Name: methyl 3,4,5-trihydroxybenzoate SMILES: COC(=O)C1=CC(=C(C(=C1)O)O)O

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PubChem CID	7428
CAS	99-24-1
Molecular Weight (g/mol)	184.147
MDL Number	MFCD00002194
SMILES	COC(=O)C1=CC(=C(C(=C1)O)O)O
Synonym	methyl gallate,gallic acid methyl ester,methylgallate,benzoic acid, 3,4,5-trihydroxy-, methyl ester,gallic acid, methyl ester,methyl galloate,unii-623d3xg80c,ccris 5567,3,4,5-trihydroxybenzoic acid methyl ester,chembl65675
IUPAC Name	methyl 3,4,5-trihydroxybenzoate
InChI Key	FBSFWRHWHYMIOG-UHFFFAOYSA-N
Molecular Formula	C8H8O5

442

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

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Specifications

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

443

Cyclopropanecarboxylic Acid 98.0+%, TCI America™

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

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Specifications

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

444

3-Indoleacrylic Acid 98.0+%, TCI America™

CAS: 1204-06-4 Molecular Formula: C11H9NO2 Molecular Weight (g/mol): 187.198 MDL Number: MFCD00005633 InChI Key: PLVPPLCLBIEYEA-AATRIKPKSA-N Synonym: 3-indoleacrylic acid,trans-3-indoleacrylic acid,indole-3-acrylic acid,3-indolylacrylic acid,indole-3beta-acrylic acid,3-1h-indol-3-yl acrylic acid,indole-3-crylic acid,2e-3-1h-indol-3-yl prop-2-enoic acid,trans-3-1h-indol-3-yl acrylic acid,indoleacrylic acid van PubChem CID: 5375048 IUPAC Name: (E)-3-(1H-indol-3-yl)prop-2-enoic acid SMILES: C1=CC=C2C(=C1)C(=CN2)C=CC(=O)O

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Specifications

PubChem CID	5375048
CAS	1204-06-4
Molecular Weight (g/mol)	187.198
MDL Number	MFCD00005633
SMILES	C1=CC=C2C(=C1)C(=CN2)C=CC(=O)O
Synonym	3-indoleacrylic acid,trans-3-indoleacrylic acid,indole-3-acrylic acid,3-indolylacrylic acid,indole-3beta-acrylic acid,3-1h-indol-3-yl acrylic acid,indole-3-crylic acid,2e-3-1h-indol-3-yl prop-2-enoic acid,trans-3-1h-indol-3-yl acrylic acid,indoleacrylic acid van
IUPAC Name	(E)-3-(1H-indol-3-yl)prop-2-enoic acid
InChI Key	PLVPPLCLBIEYEA-AATRIKPKSA-N
Molecular Formula	C11H9NO2

445

5-Norbornene-2-carboxylic Acid 98.0+%, TCI America™

CAS: 120-74-1 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.166 MDL Number: MFCD00085356 InChI Key: FYGUSUBEMUKACF-UHFFFAOYSA-N Synonym: 5-norbornene-2-carboxylic acid,bicyclo 2.2.1 hept-5-ene-2-carboxylic acid,norbornenecarboxylic acid,exo-5-norbornene-2-carboxylic acid,5-norbornene-2-carboxylic acid, exo,5-norbornene-2-carboxylic acid 8ci,bicyclo 2.2.1 hept-2-ene-5-carboxylic acid,bicyclo 2.2.1-5-heptene-2-carboxylic acid,norborn-5-ene-2-carboxylic acid PubChem CID: 78949 IUPAC Name: bicyclo[2.2.1]hept-2-ene-5-carboxylic acid SMILES: C1C2CC(C1C=C2)C(=O)O

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PubChem CID	78949
CAS	120-74-1
Molecular Weight (g/mol)	138.166
MDL Number	MFCD00085356
SMILES	C1C2CC(C1C=C2)C(=O)O
Synonym	5-norbornene-2-carboxylic acid,bicyclo 2.2.1 hept-5-ene-2-carboxylic acid,norbornenecarboxylic acid,exo-5-norbornene-2-carboxylic acid,5-norbornene-2-carboxylic acid, exo,5-norbornene-2-carboxylic acid 8ci,bicyclo 2.2.1 hept-2-ene-5-carboxylic acid,bicyclo 2.2.1-5-heptene-2-carboxylic acid,norborn-5-ene-2-carboxylic acid
IUPAC Name	bicyclo[2.2.1]hept-2-ene-5-carboxylic acid
InChI Key	FYGUSUBEMUKACF-UHFFFAOYSA-N
Molecular Formula	C8H10O2

446

Benzyl Acetate 99.0+%, TCI America™

CAS: 140-11-4 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.177 MDL Number: MFCD00008712 InChI Key: QUKGYYKBILRGFE-UHFFFAOYSA-N Synonym: acetic acid benzyl ester,benzyl ethanoate,acetic acid, phenylmethyl ester,phenylmethyl acetate,acetic acid, benzyl ester,alpha-acetoxytoluene,phenylmethyl ethanoate,acetoxymethyl benzene,benzylester kyseliny octove,caswell no. 081ea PubChem CID: 8785 ChEBI: CHEBI:52051 IUPAC Name: benzyl acetate SMILES: CC(=O)OCC1=CC=CC=C1

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PubChem CID	8785
CAS	140-11-4
Molecular Weight (g/mol)	150.177
ChEBI	CHEBI:52051
MDL Number	MFCD00008712
SMILES	CC(=O)OCC1=CC=CC=C1
Synonym	acetic acid benzyl ester,benzyl ethanoate,acetic acid, phenylmethyl ester,phenylmethyl acetate,acetic acid, benzyl ester,alpha-acetoxytoluene,phenylmethyl ethanoate,acetoxymethyl benzene,benzylester kyseliny octove,caswell no. 081ea
IUPAC Name	benzyl acetate
InChI Key	QUKGYYKBILRGFE-UHFFFAOYSA-N
Molecular Formula	C9H10O2

447

Ethyl Stearate 99.0+%, TCI America™

CAS: 111-61-5 Molecular Formula: C20H40O2 Molecular Weight (g/mol): 312.538 MDL Number: MFCD00009006 InChI Key: MVLVMROFTAUDAG-UHFFFAOYSA-N Synonym: ethyl stearate,stearic acid ethyl ester,octadecanoic acid, ethyl ester,ethyl n-octadecanoate,stearic acid, ethyl ester,dicyclohexylammonium sulfate,unii-c64rtc734w,fema no. 3490,ethyl-stearate,ethyloctadecanoate PubChem CID: 8122 ChEBI: CHEBI:84936 IUPAC Name: ethyl octadecanoate SMILES: CCCCCCCCCCCCCCCCCC(=O)OCC

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PubChem CID	8122
CAS	111-61-5
Molecular Weight (g/mol)	312.538
ChEBI	CHEBI:84936
MDL Number	MFCD00009006
SMILES	CCCCCCCCCCCCCCCCCC(=O)OCC
Synonym	ethyl stearate,stearic acid ethyl ester,octadecanoic acid, ethyl ester,ethyl n-octadecanoate,stearic acid, ethyl ester,dicyclohexylammonium sulfate,unii-c64rtc734w,fema no. 3490,ethyl-stearate,ethyloctadecanoate
IUPAC Name	ethyl octadecanoate
InChI Key	MVLVMROFTAUDAG-UHFFFAOYSA-N
Molecular Formula	C20H40O2

448

Iron(II) Acetate 90.0+%, TCI America™

CAS: 3094-87-9 Molecular Formula: C4H6FeO4 Molecular Weight (g/mol): 173.93 MDL Number: MFCD00058909 InChI Key: LNOZJRCUHSPCDZ-UHFFFAOYSA-L Synonym: iron ii acetate,ferrous acetate,iron diacetate,iron di acetate,iron 2+ acetate,acetic acid, iron 2+ salt,acetic acid, iron 2+ salt 2:1,unii-l80i7m6d3q,ferrousacetate PubChem CID: 18344 IUPAC Name: λ²-iron(2+) diacetate SMILES: [Fe++].CC([O-])=O.CC([O-])=O

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Specifications

PubChem CID	18344
CAS	3094-87-9
Molecular Weight (g/mol)	173.93
MDL Number	MFCD00058909
SMILES	[Fe++].CC([O-])=O.CC([O-])=O
Synonym	iron ii acetate,ferrous acetate,iron diacetate,iron di acetate,iron 2+ acetate,acetic acid, iron 2+ salt,acetic acid, iron 2+ salt 2:1,unii-l80i7m6d3q,ferrousacetate
IUPAC Name	λ²-iron(2+) diacetate
InChI Key	LNOZJRCUHSPCDZ-UHFFFAOYSA-L
Molecular Formula	C4H6FeO4

449

cis-3-Hexenyl Acetate 97.0+%, TCI America™

CAS: 3681-71-8 Molecular Formula: C8H14O2 Molecular Weight (g/mol): 142.198 MDL Number: MFCD00036563 InChI Key: NPFVOOAXDOBMCE-PLNGDYQASA-N Synonym: cis-3-hexenyl acetate,z-3-hexenyl acetate,z-hex-3-enyl acetate,3-hexenylacetate,cis-3-hexenyl ethanoate,cis-3-hexen-1-yl acetate,leaf acetate,3-hexen-1-ol, acetate, z,cis-3-hexenol acetate,3z-hex-3-en-1-yl acetate PubChem CID: 5363388 ChEBI: CHEBI:61316 IUPAC Name: [(Z)-hex-3-enyl] acetate SMILES: CCC=CCCOC(=O)C

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Specifications

PubChem CID	5363388
CAS	3681-71-8
Molecular Weight (g/mol)	142.198
ChEBI	CHEBI:61316
MDL Number	MFCD00036563
SMILES	CCC=CCCOC(=O)C
Synonym	cis-3-hexenyl acetate,z-3-hexenyl acetate,z-hex-3-enyl acetate,3-hexenylacetate,cis-3-hexenyl ethanoate,cis-3-hexen-1-yl acetate,leaf acetate,3-hexen-1-ol, acetate, z,cis-3-hexenol acetate,3z-hex-3-en-1-yl acetate
IUPAC Name	[(Z)-hex-3-enyl] acetate
InChI Key	NPFVOOAXDOBMCE-PLNGDYQASA-N
Molecular Formula	C8H14O2

450

(-)-Epigallocatechin Gallate Hydrate 98.0+%, TCI America™

CAS: 989-51-5 Molecular Formula: C22H18O11 Molecular Weight (g/mol): 458.375 MDL Number: MFCD00075940 InChI Key: WMBWREPUVVBILR-WIYYLYMNSA-N Synonym: =--epigallocatechin gallate,egcg,epigallocatechin gallate,epigallocatechin 3-gallate,tea catechin,epigallocatechin-3-gallate,=--epigallocatechin-3-o-gallate,teavigo,=--epigallocatechol gallate,epigallocatechin-3-monogallate PubChem CID: 65064 ChEBI: CHEBI:4806 IUPAC Name: [(2R,3R)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate SMILES: C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O

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Specifications

PubChem CID	65064
CAS	989-51-5
Molecular Weight (g/mol)	458.375
ChEBI	CHEBI:4806
MDL Number	MFCD00075940
SMILES	C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O
Synonym	=--epigallocatechin gallate,egcg,epigallocatechin gallate,epigallocatechin 3-gallate,tea catechin,epigallocatechin-3-gallate,=--epigallocatechin-3-o-gallate,teavigo,=--epigallocatechol gallate,epigallocatechin-3-monogallate
IUPAC Name	[(2R,3R)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate
InChI Key	WMBWREPUVVBILR-WIYYLYMNSA-N
Molecular Formula	C22H18O11

Monocarboxylic acids and derivatives

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