Fatty acid conjugates

Positional and geometric isomers of fatty acids with conjugated double bonds; implies four consecutive unsaturated links, and results in a delocalization of electrons along the double-bonded carbons; available in carbon chains of varying length.

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1 – 15 of 568 results

Acetylenedicarboxylic acid, 97%

CAS: 142-45-0 Molecular Formula: C4H2O4 Molecular Weight (g/mol): 114.06 MDL Number: MFCD00004362 InChI Key: YTIVTFGABIZHHX-UHFFFAOYSA-N Synonym: acetylenedicarboxylic acid,2-butynedioic acid,butynedioic acid,acetylenedicarboxylate,unii-2d2oj4ko44,acetylenedicarboxylic acid 8ci,acetylendicarboxylate,hoocc=ccooh,acetylenedicarboxylicacid,pubchem13735 PubChem CID: 371 ChEBI: CHEBI:30781 IUPAC Name: but-2-ynedioic acid SMILES: OC(=O)C#CC(O)=O

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Specifications

PubChem CID	371
CAS	142-45-0
Molecular Weight (g/mol)	114.06
ChEBI	CHEBI:30781
MDL Number	MFCD00004362
SMILES	OC(=O)C#CC(O)=O
Synonym	acetylenedicarboxylic acid,2-butynedioic acid,butynedioic acid,acetylenedicarboxylate,unii-2d2oj4ko44,acetylenedicarboxylic acid 8ci,acetylendicarboxylate,hoocc=ccooh,acetylenedicarboxylicacid,pubchem13735
IUPAC Name	but-2-ynedioic acid
InChI Key	YTIVTFGABIZHHX-UHFFFAOYSA-N
Molecular Formula	C4H2O4

2,2-Dimethylhexanoic acid, 94%, Thermo Scientific Chemicals

CAS: 813-72-9 Molecular Formula: C8H16O2 Molecular Weight (g/mol): 144.21 MDL Number: MFCD00965097 InChI Key: YTTWDTVYXAEAJA-UHFFFAOYSA-N Synonym: 2,2-dimethyl-hexanoic acid,hexanoic acid,2,2-dimethyl,2,2-dimethylhexanoicacid,dimethylhexanoic acid,dimethyl-hexanoic acid,acmc-209plb,2,2-dimethyl hexanoic acid,#,hexanoic acid, 2,2-dimethyl,yttwdtvyxaeaja-uhfffaoysa PubChem CID: 163217 IUPAC Name: 2,2-dimethylhexanoic acid SMILES: CCCCC(C)(C)C(O)=O

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Specifications

PubChem CID	163217
CAS	813-72-9
Molecular Weight (g/mol)	144.21
MDL Number	MFCD00965097
SMILES	CCCCC(C)(C)C(O)=O
Synonym	2,2-dimethyl-hexanoic acid,hexanoic acid,2,2-dimethyl,2,2-dimethylhexanoicacid,dimethylhexanoic acid,dimethyl-hexanoic acid,acmc-209plb,2,2-dimethyl hexanoic acid,#,hexanoic acid, 2,2-dimethyl,yttwdtvyxaeaja-uhfffaoysa
IUPAC Name	2,2-dimethylhexanoic acid
InChI Key	YTTWDTVYXAEAJA-UHFFFAOYSA-N
Molecular Formula	C8H16O2

5-(2-Thienyl)pentanoic acid, 95%

CAS: 21010-06-0 Molecular Formula: C9H12O2S Molecular Weight (g/mol): 184.25 MDL Number: MFCD00151849 InChI Key: OQFTZRHAQGXEQU-UHFFFAOYSA-N Synonym: 5-2-thienyl pentanoic acid,5-thiophen-2-yl pentanoic acid,2-thiophenepentanoic acid,5-2-thienyl valeric acid,maybridge3_003072,acmc-1cq6n,5-2-thienyl-pentanoic acid,5-2-thienyl-n-valeric acid PubChem CID: 152324 IUPAC Name: 5-thiophen-2-ylpentanoic acid SMILES: OC(=O)CCCCC1=CC=CS1

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Specifications

PubChem CID	152324
CAS	21010-06-0
Molecular Weight (g/mol)	184.25
MDL Number	MFCD00151849
SMILES	OC(=O)CCCCC1=CC=CS1
Synonym	5-2-thienyl pentanoic acid,5-thiophen-2-yl pentanoic acid,2-thiophenepentanoic acid,5-2-thienyl valeric acid,maybridge3_003072,acmc-1cq6n,5-2-thienyl-pentanoic acid,5-2-thienyl-n-valeric acid
IUPAC Name	5-thiophen-2-ylpentanoic acid
InChI Key	OQFTZRHAQGXEQU-UHFFFAOYSA-N
Molecular Formula	C9H12O2S

2-n-Hexyldecanoic acid, 97%

CAS: 25354-97-6 Molecular Formula: C16H32O2 Molecular Weight (g/mol): 256.43 MDL Number: MFCD00059651 InChI Key: JMOLZNNXZPAGBH-UHFFFAOYSA-N Synonym: decanoic acid, 2-hexyl,hexyldecanoic acid,c16 guerbet fatty acid,2-hexyldecansaeure,7-pentadecanecarboxylic acid,2-hexyldecansaeure german,2-hexyl-decanoic acid,2-n-hexyldecanoic acid,2-hexyldecanoicacid,isocarb 16 PubChem CID: 32912 IUPAC Name: 2-hexyldecanoic acid SMILES: CCCCCCCCC(CCCCCC)C(=O)O

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Specifications

PubChem CID	32912
CAS	25354-97-6
Molecular Weight (g/mol)	256.43
MDL Number	MFCD00059651
SMILES	CCCCCCCCC(CCCCCC)C(=O)O
Synonym	decanoic acid, 2-hexyl,hexyldecanoic acid,c16 guerbet fatty acid,2-hexyldecansaeure,7-pentadecanecarboxylic acid,2-hexyldecansaeure german,2-hexyl-decanoic acid,2-n-hexyldecanoic acid,2-hexyldecanoicacid,isocarb 16
IUPAC Name	2-hexyldecanoic acid
InChI Key	JMOLZNNXZPAGBH-UHFFFAOYSA-N
Molecular Formula	C16H32O2

Ethyl hydrogen pimelate, 98%

CAS: 33018-91-6 Molecular Formula: C9H16O4 Molecular Weight (g/mol): 188.223 MDL Number: MFCD00801202 InChI Key: NQYXFXWKKYGBNL-UHFFFAOYSA-N Synonym: ethyl hydrogen pimelate,pimelic acid monoethyl ester,heptanedioic acid monoethyl ester,ethyl hydrogen heptane-1,7-dioate,ethyl hydroden pimelate,heptandioic acid monoethyl ester,heptanedioic acid 1-ethyl ester,heptanedioic acid, 1-ethyl ester PubChem CID: 118383 IUPAC Name: 7-ethoxy-7-oxoheptanoic acid SMILES: CCOC(=O)CCCCCC(=O)O

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Specifications

PubChem CID	118383
CAS	33018-91-6
Molecular Weight (g/mol)	188.223
MDL Number	MFCD00801202
SMILES	CCOC(=O)CCCCCC(=O)O
Synonym	ethyl hydrogen pimelate,pimelic acid monoethyl ester,heptanedioic acid monoethyl ester,ethyl hydrogen heptane-1,7-dioate,ethyl hydroden pimelate,heptandioic acid monoethyl ester,heptanedioic acid 1-ethyl ester,heptanedioic acid, 1-ethyl ester
IUPAC Name	7-ethoxy-7-oxoheptanoic acid
InChI Key	NQYXFXWKKYGBNL-UHFFFAOYSA-N
Molecular Formula	C9H16O4

4,4,4-Trifluoro-3-hydroxy-3-methylbutyric acid, 98%

CAS: 338-03-4 Molecular Formula: C5H7F3O3 Molecular Weight (g/mol): 172.103 MDL Number: MFCD00039531 InChI Key: JCJGOWYCFRASTM-UHFFFAOYSA-N Synonym: 3-trifluoromethyl-3-hydroxybutyric acid,4,4,4-trifluoro-3-hydroxy-3-methylbutyric acid,3-hydroxy-3-methyl-4,4,4-trifluorobutyric acid,4,4,4-trifluoro-3-hydroxy-3-methyl-butyric acid,butanoic acid, 4,4,4-trifluoro-3-hydroxy-3-methyl,pubchem12644,acmc-20an2r,3-hydroxy-3-trifluoromethylbutyric acid,3-hydroxy-3-trifluoromethyl butyric acid PubChem CID: 136168 IUPAC Name: 4,4,4-trifluoro-3-hydroxy-3-methylbutanoic acid SMILES: CC(CC(=O)O)(C(F)(F)F)O

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Specifications

PubChem CID	136168
CAS	338-03-4
Molecular Weight (g/mol)	172.103
MDL Number	MFCD00039531
SMILES	CC(CC(=O)O)(C(F)(F)F)O
Synonym	3-trifluoromethyl-3-hydroxybutyric acid,4,4,4-trifluoro-3-hydroxy-3-methylbutyric acid,3-hydroxy-3-methyl-4,4,4-trifluorobutyric acid,4,4,4-trifluoro-3-hydroxy-3-methyl-butyric acid,butanoic acid, 4,4,4-trifluoro-3-hydroxy-3-methyl,pubchem12644,acmc-20an2r,3-hydroxy-3-trifluoromethylbutyric acid,3-hydroxy-3-trifluoromethyl butyric acid
IUPAC Name	4,4,4-trifluoro-3-hydroxy-3-methylbutanoic acid
InChI Key	JCJGOWYCFRASTM-UHFFFAOYSA-N
Molecular Formula	C5H7F3O3

Erucic acid, tech. 90%

CAS: 112-86-7 Molecular Formula: C22H42O2 Molecular Weight (g/mol): 338.576 MDL Number: MFCD00063188 InChI Key: DPUOLQHDNGRHBS-KTKRTIGZSA-N Synonym: erucic acid,cis-13-docosenoic acid,z-docos-13-enoic acid,13-docosenoic acid, z,cis-erucic acid,13-cis-docosenoic acid,13-docosenoic acid,z-13-docosenoic acid,hystrene 2290 PubChem CID: 5281116 ChEBI: CHEBI:28792 IUPAC Name: (Z)-docos-13-enoic acid SMILES: CCCCCCCCC=CCCCCCCCCCCCC(=O)O

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Specifications

PubChem CID	5281116
CAS	112-86-7
Molecular Weight (g/mol)	338.576
ChEBI	CHEBI:28792
MDL Number	MFCD00063188
SMILES	CCCCCCCCC=CCCCCCCCCCCCC(=O)O
Synonym	erucic acid,cis-13-docosenoic acid,z-docos-13-enoic acid,13-docosenoic acid, z,cis-erucic acid,13-cis-docosenoic acid,13-docosenoic acid,z-13-docosenoic acid,hystrene 2290
IUPAC Name	(Z)-docos-13-enoic acid
InChI Key	DPUOLQHDNGRHBS-KTKRTIGZSA-N
Molecular Formula	C22H42O2

(Ethylthio)acetic acid, 97%

CAS: 627-04-3 Molecular Formula: C4H8O2S Molecular Weight (g/mol): 120.166 MDL Number: MFCD00021769 InChI Key: VJIKFWJCVWFZIN-UHFFFAOYSA-N Synonym: ethylthio acetic acid,acetic acid, ethylthio,ethylthioacetic acid,ethylmercapto acetic acid,carboxymethyl ethyl sulfide,s-carboxymethyl ethyl mercaptan,2-ethylthio acetic acid,unii-m3d5y724hz,acetic acid, 2-ethylthio,ethylmercaptoacetic acid PubChem CID: 69387 IUPAC Name: 2-ethylsulfanylacetic acid SMILES: CCSCC(=O)O

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Specifications

PubChem CID	69387
CAS	627-04-3
Molecular Weight (g/mol)	120.166
MDL Number	MFCD00021769
SMILES	CCSCC(=O)O
Synonym	ethylthio acetic acid,acetic acid, ethylthio,ethylthioacetic acid,ethylmercapto acetic acid,carboxymethyl ethyl sulfide,s-carboxymethyl ethyl mercaptan,2-ethylthio acetic acid,unii-m3d5y724hz,acetic acid, 2-ethylthio,ethylmercaptoacetic acid
IUPAC Name	2-ethylsulfanylacetic acid
InChI Key	VJIKFWJCVWFZIN-UHFFFAOYSA-N
Molecular Formula	C4H8O2S

2,2-Dimethyl-3-butenoic acid, 95%

CAS: 10276-09-2 Molecular Formula: C6H10O2 Molecular Weight (g/mol): 114.144 MDL Number: MFCD00196967 InChI Key: SCFWAOWWAANBPY-UHFFFAOYSA-N PubChem CID: 139122 IUPAC Name: 2,2-dimethylbut-3-enoic acid SMILES: CC(C)(C=C)C(=O)O

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Specifications

PubChem CID	139122
CAS	10276-09-2
Molecular Weight (g/mol)	114.144
MDL Number	MFCD00196967
SMILES	CC(C)(C=C)C(=O)O
IUPAC Name	2,2-dimethylbut-3-enoic acid
InChI Key	SCFWAOWWAANBPY-UHFFFAOYSA-N
Molecular Formula	C6H10O2

2,3-Dibromobutyric acid, 97%

CAS: 600-30-6 Molecular Formula: C4H6Br2O2 Molecular Weight (g/mol): 245.898 MDL Number: MFCD00014334 InChI Key: HESQKTULJLBDRF-UHFFFAOYSA-N Synonym: 2,3-dibromobutyric acid,.alpha.,.beta.-dibromobutyric acid,2,3-dibromo-butyric acid,acmc-1atov,2,3 dibromobutyric acid,#,butanoic acid,2,3-dibromo,butanoic acid, 2,3-dibromo,alpha,beta-dibromo-n-butyric acid,.alpha.,.beta.-dibromo-n-butyric acid PubChem CID: 95386 IUPAC Name: 2,3-dibromobutanoic acid SMILES: CC(C(C(=O)O)Br)Br

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Specifications

PubChem CID	95386
CAS	600-30-6
Molecular Weight (g/mol)	245.898
MDL Number	MFCD00014334
SMILES	CC(C(C(=O)O)Br)Br
Synonym	2,3-dibromobutyric acid,.alpha.,.beta.-dibromobutyric acid,2,3-dibromo-butyric acid,acmc-1atov,2,3 dibromobutyric acid,#,butanoic acid,2,3-dibromo,butanoic acid, 2,3-dibromo,alpha,beta-dibromo-n-butyric acid,.alpha.,.beta.-dibromo-n-butyric acid
IUPAC Name	2,3-dibromobutanoic acid
InChI Key	HESQKTULJLBDRF-UHFFFAOYSA-N
Molecular Formula	C4H6Br2O2

tert-Butyl hydrogen succinate, 97%

CAS: 15026-17-2 Molecular Formula: C8H14O4 Molecular Weight (g/mol): 174.20 MDL Number: MFCD00273441 InChI Key: PCOCFIOYWNCGBM-UHFFFAOYSA-N Synonym: mono-tert-butyl succinate,4-tert-butoxy-4-oxobutanoic acid,succinic acid mono-tert-butyl ester,tert-butyl hydrogen succinate,mono-t-butyl succinate,pubchem11616,succinic acid 1-tert-butyl ester,succinic acid 4-tert-butyl ester PubChem CID: 4139107 IUPAC Name: 4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoic acid SMILES: CC(C)(C)OC(=O)CCC(O)=O

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Specifications

PubChem CID	4139107
CAS	15026-17-2
Molecular Weight (g/mol)	174.20
MDL Number	MFCD00273441
SMILES	CC(C)(C)OC(=O)CCC(O)=O
Synonym	mono-tert-butyl succinate,4-tert-butoxy-4-oxobutanoic acid,succinic acid mono-tert-butyl ester,tert-butyl hydrogen succinate,mono-t-butyl succinate,pubchem11616,succinic acid 1-tert-butyl ester,succinic acid 4-tert-butyl ester
IUPAC Name	4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoic acid
InChI Key	PCOCFIOYWNCGBM-UHFFFAOYSA-N
Molecular Formula	C8H14O4

Perfluorotetradecanoic acid, 96%

CAS: 376-06-7 Molecular Formula: C14HF27O2 Molecular Weight (g/mol): 714.117 MDL Number: MFCD00153263 InChI Key: RUDINRUXCKIXAJ-UHFFFAOYSA-N Synonym: perfluorotetradecanoic acid,perfluoromyristic acid,heptacosafluorotetradecanoic acid,tetradecanoic acid, heptacosafluoro,acmc-20ajxq,perfluorotetradecanoic acid, analytical standard PubChem CID: 67822 IUPAC Name: 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-heptacosafluorotetradecanoic acid SMILES: C(=O)(C(C(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O

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Specifications

PubChem CID	67822
CAS	376-06-7
Molecular Weight (g/mol)	714.117
MDL Number	MFCD00153263
SMILES	C(=O)(C(C(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O
Synonym	perfluorotetradecanoic acid,perfluoromyristic acid,heptacosafluorotetradecanoic acid,tetradecanoic acid, heptacosafluoro,acmc-20ajxq,perfluorotetradecanoic acid, analytical standard
IUPAC Name	2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-heptacosafluorotetradecanoic acid
InChI Key	RUDINRUXCKIXAJ-UHFFFAOYSA-N
Molecular Formula	C14HF27O2

10,12-Tricosadiynoic acid, 96%

CAS: 66990-30-5 Molecular Formula: C23H38O2 Molecular Weight (g/mol): 346.555 MDL Number: MFCD00041683 InChI Key: DIEDVCMBPCRJFQ-UHFFFAOYSA-N Synonym: 10,12-tricosadiynoic acid,10,12-tricosadiynoicacid,acmc-209nx8,10,12-tricosadiynoic acid gc PubChem CID: 538457 IUPAC Name: tricosa-10,12-diynoic acid SMILES: CCCCCCCCCCC#CC#CCCCCCCCCC(=O)O

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Specifications

PubChem CID	538457
CAS	66990-30-5
Molecular Weight (g/mol)	346.555
MDL Number	MFCD00041683
SMILES	CCCCCCCCCCC#CC#CCCCCCCCCC(=O)O
Synonym	10,12-tricosadiynoic acid,10,12-tricosadiynoicacid,acmc-209nx8,10,12-tricosadiynoic acid gc
IUPAC Name	tricosa-10,12-diynoic acid
InChI Key	DIEDVCMBPCRJFQ-UHFFFAOYSA-N
Molecular Formula	C23H38O2

10,12-Pentacosadiynoic acid, 98+%

CAS: 66990-32-7 Molecular Formula: C25H42O2 Molecular Weight (g/mol): 374.61 MDL Number: MFCD00041684 InChI Key: ZPUDRBWHCWYMQS-UHFFFAOYSA-N Synonym: 10,12-pentacosadiynoic acid,10,12-pentacosadiynoicacid,acmc-209nx9,10-12-pentacosadiynoic acid,10,12-pentacosadiynoic acid hplc PubChem CID: 538433 IUPAC Name: pentacosa-10,12-diynoic acid SMILES: CCCCCCCCCCCCC#CC#CCCCCCCCCC(O)=O

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Specifications

PubChem CID	538433
CAS	66990-32-7
Molecular Weight (g/mol)	374.61
MDL Number	MFCD00041684
SMILES	CCCCCCCCCCCCC#CC#CCCCCCCCCC(O)=O
Synonym	10,12-pentacosadiynoic acid,10,12-pentacosadiynoicacid,acmc-209nx9,10-12-pentacosadiynoic acid,10,12-pentacosadiynoic acid hplc
IUPAC Name	pentacosa-10,12-diynoic acid
InChI Key	ZPUDRBWHCWYMQS-UHFFFAOYSA-N
Molecular Formula	C25H42O2

trans,trans-1,3-Butadiene-1,4-dicarboxylic acid, 98%

CAS: 3588-17-8 Molecular Formula: C6H6O4 Molecular Weight (g/mol): 142.11 MDL Number: MFCD00002702 InChI Key: TXXHDPDFNKHHGW-ZPUQHVIOSA-N Synonym: trans,trans-muconic acid,muconic acid,e,e-muconic acid,2,4-hexadienedioic acid,trans, trans-muconic acid,hexa-2,4-dienedioic acid,2e,4e-hexa-2,4-dienedioic acid,1,3-butadiene-1,4-dicarboxylic acid,2,4-hexadienedioic acid, e,e,trans,trans-2,4-hexadienedioic acid PubChem CID: 5356793 ChEBI: CHEBI:27036 IUPAC Name: (2E,4E)-hexa-2,4-dienedioic acid SMILES: C(=CC(=O)O)C=CC(=O)O

Pricing and Availability
Specifications

PubChem CID	5356793
CAS	3588-17-8
Molecular Weight (g/mol)	142.11
ChEBI	CHEBI:27036
MDL Number	MFCD00002702
SMILES	C(=CC(=O)O)C=CC(=O)O
Synonym	trans,trans-muconic acid,muconic acid,e,e-muconic acid,2,4-hexadienedioic acid,trans, trans-muconic acid,hexa-2,4-dienedioic acid,2e,4e-hexa-2,4-dienedioic acid,1,3-butadiene-1,4-dicarboxylic acid,2,4-hexadienedioic acid, e,e,trans,trans-2,4-hexadienedioic acid
IUPAC Name	(2E,4E)-hexa-2,4-dienedioic acid
InChI Key	TXXHDPDFNKHHGW-ZPUQHVIOSA-N
Molecular Formula	C6H6O4

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