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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 – 9 of 9 results
1

Itaconic acid, 99+%

CAS: 97-65-4 Molecular Formula: C5H6O4 Molecular Weight (g/mol): 130.1 InChI Key: LVHBHZANLOWSRM-UHFFFAOYSA-N Synonym: itaconic acid,2-methylenesuccinic acid,methylenesuccinic acid,methylenebutanedioic acid,propylenedicarboxylic acid,itaconate,2-propene-1,2-dicarboxylic acid,butanedioic acid, methylene,succinic acid, methylene,2-methylenebutanedioic acid PubChem CID: 811 ChEBI: CHEBI:30838 IUPAC Name: 2-methylidenebutanedioic acid SMILES: C=C(CC(=O)O)C(=O)O

EDGE
PubChem CID 811
CAS 97-65-4
Molecular Weight (g/mol) 130.1
ChEBI CHEBI:30838
SMILES C=C(CC(=O)O)C(=O)O
Synonym itaconic acid,2-methylenesuccinic acid,methylenesuccinic acid,methylenebutanedioic acid,propylenedicarboxylic acid,itaconate,2-propene-1,2-dicarboxylic acid,butanedioic acid, methylene,succinic acid, methylene,2-methylenebutanedioic acid
IUPAC Name 2-methylidenebutanedioic acid
InChI Key LVHBHZANLOWSRM-UHFFFAOYSA-N
Molecular Formula C5H6O4
2
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Thermo Scientific Chemicals Linolenic acid, 99%

CAS: 463-40-1 Molecular Formula: C18H30O2 Molecular Weight (g/mol): 278.44 MDL Number: MFCD00065720 InChI Key: DTOSIQBPPRVQHS-PDBXOOCHSA-N Synonym: linolenic acid,alpha-linolenic acid,linolenate,9z,12z,15z-octadeca-9,12,15-trienoic acid,a-linolenic acid,cis,cis,cis-9,12,15-octadecatrienoic acid,all-cis-9,12,15-octadecatrienoic acid,alpha-linolenate,9-cis,12-cis,15-cis-octadecatrienoic acid,z,z,z-9,12,15-octadecatrienoic acid PubChem CID: 5280934 ChEBI: CHEBI:27432 IUPAC Name: (9Z,12Z,15Z)-octadeca-9,12,15-trienoic acid SMILES: CCC=CCC=CCC=CCCCCCCCC(=O)O

EDGE
PubChem CID 5280934
CAS 463-40-1
Molecular Weight (g/mol) 278.44
ChEBI CHEBI:27432
MDL Number MFCD00065720
SMILES CCC=CCC=CCC=CCCCCCCCC(=O)O
Synonym linolenic acid,alpha-linolenic acid,linolenate,9z,12z,15z-octadeca-9,12,15-trienoic acid,a-linolenic acid,cis,cis,cis-9,12,15-octadecatrienoic acid,all-cis-9,12,15-octadecatrienoic acid,alpha-linolenate,9-cis,12-cis,15-cis-octadecatrienoic acid,z,z,z-9,12,15-octadecatrienoic acid
IUPAC Name (9Z,12Z,15Z)-octadeca-9,12,15-trienoic acid
InChI Key DTOSIQBPPRVQHS-PDBXOOCHSA-N
Molecular Formula C18H30O2
3

Octanoic acid, 99%

CAS: 124-07-2 Molecular Formula: C8H16O2 Molecular Weight (g/mol): 144.21 MDL Number: MFCD00004429 InChI Key: WWZKQHOCKIZLMA-UHFFFAOYSA-N Synonym: caprylic acid,n-octanoic acid,octylic acid,n-caprylic acid,octoic acid,n-octylic acid,n-octoic acid,neo-fat 8,1-heptanecarboxylic acid,enantic acid PubChem CID: 379 ChEBI: CHEBI:28837 IUPAC Name: octanoic acid SMILES: CCCCCCCC(=O)O

PubChem CID 379
CAS 124-07-2
Molecular Weight (g/mol) 144.21
ChEBI CHEBI:28837
MDL Number MFCD00004429
SMILES CCCCCCCC(=O)O
Synonym caprylic acid,n-octanoic acid,octylic acid,n-caprylic acid,octoic acid,n-octylic acid,n-octoic acid,neo-fat 8,1-heptanecarboxylic acid,enantic acid
IUPAC Name octanoic acid
InChI Key WWZKQHOCKIZLMA-UHFFFAOYSA-N
Molecular Formula C8H16O2
4

n-Nonanoic acid, 97%

CAS: 112-05-0 Molecular Formula: C9H18O2 Molecular Weight (g/mol): 158.24 MDL Number: MFCD00004433 InChI Key: FBUKVWPVBMHYJY-UHFFFAOYSA-N Synonym: pelargonic acid,n-nonanoic acid,nonylic acid,pelargic acid,nonoic acid,n-nonylic acid,n-nonoic acid,1-octanecarboxylic acid,pelargon,cirrasol 185a PubChem CID: 8158 ChEBI: CHEBI:29019 IUPAC Name: nonanoic acid SMILES: CCCCCCCCC(=O)O

PubChem CID 8158
CAS 112-05-0
Molecular Weight (g/mol) 158.24
ChEBI CHEBI:29019
MDL Number MFCD00004433
SMILES CCCCCCCCC(=O)O
Synonym pelargonic acid,n-nonanoic acid,nonylic acid,pelargic acid,nonoic acid,n-nonylic acid,n-nonoic acid,1-octanecarboxylic acid,pelargon,cirrasol 185a
IUPAC Name nonanoic acid
InChI Key FBUKVWPVBMHYJY-UHFFFAOYSA-N
Molecular Formula C9H18O2
5

Heptanoic acid, 98%

CAS: 111-14-8 Molecular Formula: C7H14O2 Molecular Weight (g/mol): 130.19 MDL Number: MFCD00004426 InChI Key: MNWFXJYAOYHMED-UHFFFAOYSA-N Synonym: enanthic acid,oenanthic acid,n-heptanoic acid,enanthylic acid,heptoic acid,n-heptoic acid,n-heptylic acid,heptylic acid,oenanthylic acid,1-hexanecarboxylic acid PubChem CID: 8094 ChEBI: CHEBI:45571 IUPAC Name: heptanoic acid SMILES: CCCCCCC(=O)O

PubChem CID 8094
CAS 111-14-8
Molecular Weight (g/mol) 130.19
ChEBI CHEBI:45571
MDL Number MFCD00004426
SMILES CCCCCCC(=O)O
Synonym enanthic acid,oenanthic acid,n-heptanoic acid,enanthylic acid,heptoic acid,n-heptoic acid,n-heptylic acid,heptylic acid,oenanthylic acid,1-hexanecarboxylic acid
IUPAC Name heptanoic acid
InChI Key MNWFXJYAOYHMED-UHFFFAOYSA-N
Molecular Formula C7H14O2
6

4-Bromobutyric acid, 97%

CAS: 2623-87-2 Molecular Formula: C4H7BrO2 Molecular Weight (g/mol): 167.00 MDL Number: MFCD00002817 InChI Key: GRHQDJDRGZFIPO-UHFFFAOYSA-N Synonym: 4-bromobutyric acid,butanoic acid, 4-bromo,4-bromo-n-butyric acid,butyric acid, 4-bromo,gamma-bromobutyric acid,rarechem al bo 0176,4-bromobutyricacid,carboxypropyl bromide,4-bromo-butyric acid,pubchem3754 PubChem CID: 75809 IUPAC Name: 4-bromobutanoic acid SMILES: OC(=O)CCCBr

PubChem CID 75809
CAS 2623-87-2
Molecular Weight (g/mol) 167.00
MDL Number MFCD00002817
SMILES OC(=O)CCCBr
Synonym 4-bromobutyric acid,butanoic acid, 4-bromo,4-bromo-n-butyric acid,butyric acid, 4-bromo,gamma-bromobutyric acid,rarechem al bo 0176,4-bromobutyricacid,carboxypropyl bromide,4-bromo-butyric acid,pubchem3754
IUPAC Name 4-bromobutanoic acid
InChI Key GRHQDJDRGZFIPO-UHFFFAOYSA-N
Molecular Formula C4H7BrO2
7

5-Methylhexanoic acid, 98%

CAS: 628-46-6 Molecular Formula: C7H14O2 Molecular Weight (g/mol): 130.19 MDL Number: MFCD00036494 InChI Key: MHPUGCYGQWGLJL-UHFFFAOYSA-N Synonym: isoheptanoic acid,isoenanthic acid,5-methylcaproic acid,isoamylacetic acid,hexanoic acid, 5-methyl,isovenanthic acid,5-methylhexylic acid,5-methyl-hexanoic acid,5-methyl hexanoic acid,unii-n1ak4x34c2 PubChem CID: 12344 IUPAC Name: 5-methylhexanoic acid SMILES: CC(C)CCCC(O)=O

PubChem CID 12344
CAS 628-46-6
Molecular Weight (g/mol) 130.19
MDL Number MFCD00036494
SMILES CC(C)CCCC(O)=O
Synonym isoheptanoic acid,isoenanthic acid,5-methylcaproic acid,isoamylacetic acid,hexanoic acid, 5-methyl,isovenanthic acid,5-methylhexylic acid,5-methyl-hexanoic acid,5-methyl hexanoic acid,unii-n1ak4x34c2
IUPAC Name 5-methylhexanoic acid
InChI Key MHPUGCYGQWGLJL-UHFFFAOYSA-N
Molecular Formula C7H14O2
8

Cyclohexanepropionic acid, 99%

CAS: 701-97-3 Molecular Formula: C9H16O2 Molecular Weight (g/mol): 156.23 MDL Number: MFCD00001527 InChI Key: HJZLEGIHUQOJBA-UHFFFAOYSA-N Synonym: cyclohexanepropionic acid,3-cyclohexylpropionic acid,cyclohexanepropanoic acid,3-cyclohexanepropionic acid,cyclohexane propionic acid,unii-u36w9hnv6d,3-cyclohexyl propionic acid,3-cyclohexyl-propionic acid,u36w9hnv6d,cyclohexyl propionic acid PubChem CID: 69702 IUPAC Name: 3-cyclohexylpropanoic acid SMILES: OC(=O)CCC1CCCCC1

PubChem CID 69702
CAS 701-97-3
Molecular Weight (g/mol) 156.23
MDL Number MFCD00001527
SMILES OC(=O)CCC1CCCCC1
Synonym cyclohexanepropionic acid,3-cyclohexylpropionic acid,cyclohexanepropanoic acid,3-cyclohexanepropionic acid,cyclohexane propionic acid,unii-u36w9hnv6d,3-cyclohexyl propionic acid,3-cyclohexyl-propionic acid,u36w9hnv6d,cyclohexyl propionic acid
IUPAC Name 3-cyclohexylpropanoic acid
InChI Key HJZLEGIHUQOJBA-UHFFFAOYSA-N
Molecular Formula C9H16O2
9

Thermo Scientific Chemicals Vinylacetic acid, tech., 90%, unstabilized

CAS: 625-38-7 Molecular Formula: C4H6O2 Molecular Weight (g/mol): 86.09 MDL Number: MFCD00002782 InChI Key: PVEOYINWKBTPIZ-UHFFFAOYSA-N Synonym: 3-butenoic acid,vinylacetic acid,vinyl acetic acid,acetic acid, ethenyl,beta-butenoic acid,.beta.-butenoic acid,2-propenylcarboxylic acid,allylic acid,vinylessigsaeure,3-butenoicacid PubChem CID: 32743 ChEBI: CHEBI:35897 IUPAC Name: but-3-enoic acid SMILES: OC(=O)CC=C

PubChem CID 32743
CAS 625-38-7
Molecular Weight (g/mol) 86.09
ChEBI CHEBI:35897
MDL Number MFCD00002782
SMILES OC(=O)CC=C
Synonym 3-butenoic acid,vinylacetic acid,vinyl acetic acid,acetic acid, ethenyl,beta-butenoic acid,.beta.-butenoic acid,2-propenylcarboxylic acid,allylic acid,vinylessigsaeure,3-butenoicacid
IUPAC Name but-3-enoic acid
InChI Key PVEOYINWKBTPIZ-UHFFFAOYSA-N
Molecular Formula C4H6O2