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.

1 – 15 of 559 results

Sodium caprylate, 98%

CAS: 1984-06-1 Molecular Formula: C₈H₁₅NaO₂ Molecular Weight (g/mol): 166.2 MDL Number: MFCD00058511 InChI Key: BYKRNSHANADUFY-UHFFFAOYSA-M Synonym: sodium octanoate,sodium caprylate,octanoic acid, sodium salt,sodium n-octanoate,sodium octoate,natrium octanoat,caprylic acid sodium salt,octanoic acid sodium salt,octanoic acid, sodium salt 1:1,unii-9xtm81vk2b PubChem CID: 23664772

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PubChem CID	23664772
CAS	1984-06-1
Molecular Weight (g/mol)	166.2
MDL Number	MFCD00058511
Synonym	sodium octanoate,sodium caprylate,octanoic acid, sodium salt,sodium n-octanoate,sodium octoate,natrium octanoat,caprylic acid sodium salt,octanoic acid sodium salt,octanoic acid, sodium salt 1:1,unii-9xtm81vk2b
InChI Key	BYKRNSHANADUFY-UHFFFAOYSA-M
Molecular Formula	C₈H₁₅NaO₂

Oleic acid, tech. 90%

CAS: 112-80-1 Molecular Formula: C18H34O2 Molecular Weight (g/mol): 282.47 MDL Number: MFCD00064242 InChI Key: ZQPPMHVWECSIRJ-MDZDMXLPSA-N Synonym: oleic acid,cis-9-octadecenoic acid,cis-oleic acid,elaidoic acid,oleate,glycon wo,wecoline oo,pamolyn 100,glycon ro,z-octadec-9-enoic acid PubChem CID: 445639 ChEBI: CHEBI:16196 SMILES: CCCCCCCC\C=C\CCCCCCCC(O)=O

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PubChem CID	445639
CAS	112-80-1
Molecular Weight (g/mol)	282.47
ChEBI	CHEBI:16196
MDL Number	MFCD00064242
SMILES	CCCCCCCC\C=C\CCCCCCCC(O)=O
Synonym	oleic acid,cis-9-octadecenoic acid,cis-oleic acid,elaidoic acid,oleate,glycon wo,wecoline oo,pamolyn 100,glycon ro,z-octadec-9-enoic acid
InChI Key	ZQPPMHVWECSIRJ-MDZDMXLPSA-N
Molecular Formula	C18H34O2

Selectophore™ Oleic acid, ≥99.0%, MilliporeSigma™ Supelco™

MDL Number: MFCD00064242 Synonym: cis-9-Octadecenoic acid; Elainic acid

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MDL Number	MFCD00064242
Synonym	cis-9-Octadecenoic acid; Elainic acid

Itaconic acid, 99%

CAS: 97-65-4 Molecular Formula: C5H6O4 Molecular Weight (g/mol): 130.099 MDL Number: MFCD00004260 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

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Specifications

PubChem CID	811
CAS	97-65-4
Molecular Weight (g/mol)	130.099
ChEBI	CHEBI:30838
MDL Number	MFCD00004260
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

6-Bromohexanoic acid, 98+%

CAS: 4224-70-8 Molecular Formula: C6H11BrO2 Molecular Weight (g/mol): 195.056 MDL Number: MFCD00004422 InChI Key: NVRVNSHHLPQGCU-UHFFFAOYSA-N Synonym: 6-bromocaproic acid,hexanoic acid, 6-bromo,6-bromo-hexanoic acid,6-bromo-n-caproic acid,6-bromo hexanoic acid,epsilon-bromo caproic acid,6-bromo hexanoicacid,6bromohexanoic acid,6-bromo-hexanicacid,6-bromo-caproic acid PubChem CID: 20210 ChEBI: CHEBI:60700 IUPAC Name: 6-bromohexanoic acid SMILES: C(CCC(=O)O)CCBr

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Specifications

PubChem CID	20210
CAS	4224-70-8
Molecular Weight (g/mol)	195.056
ChEBI	CHEBI:60700
MDL Number	MFCD00004422
SMILES	C(CCC(=O)O)CCBr
Synonym	6-bromocaproic acid,hexanoic acid, 6-bromo,6-bromo-hexanoic acid,6-bromo-n-caproic acid,6-bromo hexanoic acid,epsilon-bromo caproic acid,6-bromo hexanoicacid,6bromohexanoic acid,6-bromo-hexanicacid,6-bromo-caproic acid
IUPAC Name	6-bromohexanoic acid
InChI Key	NVRVNSHHLPQGCU-UHFFFAOYSA-N
Molecular Formula	C6H11BrO2

trans-Crotonic acid, 98%

CAS: 107-93-7 Molecular Formula: C4H6O2 Molecular Weight (g/mol): 86.09 MDL Number: MFCD00002701 InChI Key: LDHQCZJRKDOVOX-NSCUHMNNSA-N Synonym: crotonic acid,e-but-2-enoic acid,but-2-enoic acid,trans-2-butenoic acid,trans-crotonic acid,3-methylacrylic acid,e-2-butenoic acid,2-butenoic acid,2e-but-2-enoic acid,e-crotonic acid PubChem CID: 637090 ChEBI: CHEBI:41131 IUPAC Name: (E)-but-2-enoic acid SMILES: CC=CC(=O)O

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Specifications

PubChem CID	637090
CAS	107-93-7
Molecular Weight (g/mol)	86.09
ChEBI	CHEBI:41131
MDL Number	MFCD00002701
SMILES	CC=CC(=O)O
Synonym	crotonic acid,e-but-2-enoic acid,but-2-enoic acid,trans-2-butenoic acid,trans-crotonic acid,3-methylacrylic acid,e-2-butenoic acid,2-butenoic acid,2e-but-2-enoic acid,e-crotonic acid
IUPAC Name	(E)-but-2-enoic acid
InChI Key	LDHQCZJRKDOVOX-NSCUHMNNSA-N
Molecular Formula	C4H6O2

Mucobromic acid, 98+%

CAS: 488-11-9 Molecular Formula: C4HBr2O3- Molecular Weight (g/mol): 256.857 MDL Number: MFCD00063745 InChI Key: NCNYEGJDGNOYJX-IHWYPQMZSA-M Synonym: mucobromic acid,z-2,3-dibromo-4-oxo-2-butenoate,z-2,3-dibromo-4-oxobut-2-enoate,2z-2,3-dibromo-4-oxobut-2-enoate,z-2,3-bis bromanyl-4-oxidanylidene-but-2-enoate PubChem CID: 6994897 IUPAC Name: (Z)-2,3-dibromo-4-oxobut-2-enoate SMILES: C(=O)C(=C(C(=O)[O-])Br)Br

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Specifications

PubChem CID	6994897
CAS	488-11-9
Molecular Weight (g/mol)	256.857
MDL Number	MFCD00063745
SMILES	C(=O)C(=C(C(=O)[O-])Br)Br
Synonym	mucobromic acid,z-2,3-dibromo-4-oxo-2-butenoate,z-2,3-dibromo-4-oxobut-2-enoate,2z-2,3-dibromo-4-oxobut-2-enoate,z-2,3-bis bromanyl-4-oxidanylidene-but-2-enoate
IUPAC Name	(Z)-2,3-dibromo-4-oxobut-2-enoate
InChI Key	NCNYEGJDGNOYJX-IHWYPQMZSA-M
Molecular Formula	C4HBr2O3-

2-Methyl-2-pentenoic acid, 99%

CAS: 3142-72-1 Molecular Formula: C6H10O2 Molecular Weight (g/mol): 114.144 MDL Number: MFCD00002655 InChI Key: JJYWRQLLQAKNAD-SNAWJCMRSA-N Synonym: 2-methyl-2-pentenoic acid,trans-2-methyl-2-pentenoic acid,e-2-methylpent-2-enoic acid,e-2-methyl-2-pentenoic acid,2-pentenoic acid, 2-methyl,2-pentenoic acid, 2-methyl-, e,e-2-methylpent-2-en-1-oic acid,s-2-methylpentenoic acid,2e-2-methylpent-2-enoic acid,2-methylpent-2-en-1-oic acid PubChem CID: 5365909 IUPAC Name: (E)-2-methylpent-2-enoic acid SMILES: CCC=C(C)C(=O)O

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Specifications

PubChem CID	5365909
CAS	3142-72-1
Molecular Weight (g/mol)	114.144
MDL Number	MFCD00002655
SMILES	CCC=C(C)C(=O)O
Synonym	2-methyl-2-pentenoic acid,trans-2-methyl-2-pentenoic acid,e-2-methylpent-2-enoic acid,e-2-methyl-2-pentenoic acid,2-pentenoic acid, 2-methyl,2-pentenoic acid, 2-methyl-, e,e-2-methylpent-2-en-1-oic acid,s-2-methylpentenoic acid,2e-2-methylpent-2-enoic acid,2-methylpent-2-en-1-oic acid
IUPAC Name	(E)-2-methylpent-2-enoic acid
InChI Key	JJYWRQLLQAKNAD-SNAWJCMRSA-N
Molecular Formula	C6H10O2

3,3-Dimethylacrylic acid, 98%

CAS: 541-47-9 Molecular Formula: C5H8O2 Molecular Weight (g/mol): 100.117 MDL Number: MFCD00004366 InChI Key: YYPNJNDODFVZLE-UHFFFAOYSA-N Synonym: 3,3-dimethylacrylic acid,senecioic acid,3-methylcrotonic acid,3-methyl-2-butenoic acid,2-butenoic acid, 3-methyl,senecic acid,beta,beta-dimethylacrylic acid,crotonic acid, 3-methyl,beta,beta-dimethacrylic acid,beta-methylcrotonic acid PubChem CID: 10931 ChEBI: CHEBI:37127 IUPAC Name: 3-methylbut-2-enoic acid SMILES: CC(=CC(=O)O)C

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Specifications

PubChem CID	10931
CAS	541-47-9
Molecular Weight (g/mol)	100.117
ChEBI	CHEBI:37127
MDL Number	MFCD00004366
SMILES	CC(=CC(=O)O)C
Synonym	3,3-dimethylacrylic acid,senecioic acid,3-methylcrotonic acid,3-methyl-2-butenoic acid,2-butenoic acid, 3-methyl,senecic acid,beta,beta-dimethylacrylic acid,crotonic acid, 3-methyl,beta,beta-dimethacrylic acid,beta-methylcrotonic acid
IUPAC Name	3-methylbut-2-enoic acid
InChI Key	YYPNJNDODFVZLE-UHFFFAOYSA-N
Molecular Formula	C5H8O2

2-Ethylbutyric acid, 98%

CAS: 88-09-5 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00002670 InChI Key: OXQGTIUCKGYOAA-UHFFFAOYSA-N Synonym: 2-ethylbutyric acid,diethylacetic acid,butanoic acid, 2-ethyl,acetic acid, diethyl,3-pentanecarboxylic acid,2-ethyl butanoic acid,diethyl acetic acid,butyric acid, 2-ethyl,2-ethyl-butyric acid,alpha-ethylbutyric acid PubChem CID: 6915 IUPAC Name: 2-ethylbutanoic acid SMILES: CCC(CC)C(=O)O

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Specifications

PubChem CID	6915
CAS	88-09-5
Molecular Weight (g/mol)	116.16
MDL Number	MFCD00002670
SMILES	CCC(CC)C(=O)O
Synonym	2-ethylbutyric acid,diethylacetic acid,butanoic acid, 2-ethyl,acetic acid, diethyl,3-pentanecarboxylic acid,2-ethyl butanoic acid,diethyl acetic acid,butyric acid, 2-ethyl,2-ethyl-butyric acid,alpha-ethylbutyric acid
IUPAC Name	2-ethylbutanoic acid
InChI Key	OXQGTIUCKGYOAA-UHFFFAOYSA-N
Molecular Formula	C6H12O2

8-Aminooctanoic acid, 99%

CAS: 1002-57-9 Molecular Formula: C8H17NO2 Molecular Weight (g/mol): 159.23 MDL Number: MFCD00008245 InChI Key: UQXNEWQGGVUVQA-UHFFFAOYSA-N Synonym: 8-aminocaprylic acid,octanoic acid, 8-amino,omega-aminocaprylic acid,8-amino caprylic acid,8-amino-octanoic acid,.omega.-aminocaprylic acid,8-amino capylic acid,8ac,8-aminocapylic acid,pubchem13165 PubChem CID: 66085 IUPAC Name: 8-aminooctanoic acid SMILES: NCCCCCCCC(O)=O

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Specifications

PubChem CID	66085
CAS	1002-57-9
Molecular Weight (g/mol)	159.23
MDL Number	MFCD00008245
SMILES	NCCCCCCCC(O)=O
Synonym	8-aminocaprylic acid,octanoic acid, 8-amino,omega-aminocaprylic acid,8-amino caprylic acid,8-amino-octanoic acid,.omega.-aminocaprylic acid,8-amino capylic acid,8ac,8-aminocapylic acid,pubchem13165
IUPAC Name	8-aminooctanoic acid
InChI Key	UQXNEWQGGVUVQA-UHFFFAOYSA-N
Molecular Formula	C8H17NO2

12-Hydroxystearic acid, tech. 85%

CAS: 106-14-9 Molecular Formula: C18H36O3 Molecular Weight (g/mol): 300.483 MDL Number: MFCD00004592 InChI Key: ULQISTXYYBZJSJ-UHFFFAOYSA-N Synonym: 12-hydroxystearic acid,octadecanoic acid, 12-hydroxy,harwax a,cerit fac 3,hydrofol acid 200,dl-12-hydroxystearic acid,ceroxin gl,barolub fto,loxiol g 21,stearic acid, 12-hydroxy PubChem CID: 7789 ChEBI: CHEBI:85208 IUPAC Name: 12-hydroxyoctadecanoic acid SMILES: CCCCCCC(CCCCCCCCCCC(=O)O)O

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Specifications

PubChem CID	7789
CAS	106-14-9
Molecular Weight (g/mol)	300.483
ChEBI	CHEBI:85208
MDL Number	MFCD00004592
SMILES	CCCCCCC(CCCCCCCCCCC(=O)O)O
Synonym	12-hydroxystearic acid,octadecanoic acid, 12-hydroxy,harwax a,cerit fac 3,hydrofol acid 200,dl-12-hydroxystearic acid,ceroxin gl,barolub fto,loxiol g 21,stearic acid, 12-hydroxy
IUPAC Name	12-hydroxyoctadecanoic acid
InChI Key	ULQISTXYYBZJSJ-UHFFFAOYSA-N
Molecular Formula	C18H36O3

Heptanoic acid, 98+%

CAS: 111-14-8 Molecular Formula: C7H14O2 Molecular Weight (g/mol): 130.187 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

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Specifications

PubChem CID	8094
CAS	111-14-8
Molecular Weight (g/mol)	130.187
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

16-Hydroxyhexadecanoic acid, 97%

CAS: 506-13-8 Molecular Formula: C16H32O3 Molecular Weight (g/mol): 272.429 MDL Number: MFCD00002750 InChI Key: UGAGPNKCDRTDHP-UHFFFAOYSA-N Synonym: juniperic acid,16-hydroxypalmitic acid,hexadecanoic acid, 16-hydroxy,palmitic acid, 16-hydroxy,omega-hydroxypalmitic acid,16-hydroxy-hexadecanoic acid,unii-7ipp3u0f3i,.omega.-hydroxypalmitic acid,7ipp3u0f3i,16-hydroxy hexadecanoic acid PubChem CID: 10466 ChEBI: CHEBI:55328 IUPAC Name: 16-hydroxyhexadecanoic acid SMILES: C(CCCCCCCC(=O)O)CCCCCCCO

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Specifications

PubChem CID	10466
CAS	506-13-8
Molecular Weight (g/mol)	272.429
ChEBI	CHEBI:55328
MDL Number	MFCD00002750
SMILES	C(CCCCCCCC(=O)O)CCCCCCCO
Synonym	juniperic acid,16-hydroxypalmitic acid,hexadecanoic acid, 16-hydroxy,palmitic acid, 16-hydroxy,omega-hydroxypalmitic acid,16-hydroxy-hexadecanoic acid,unii-7ipp3u0f3i,.omega.-hydroxypalmitic acid,7ipp3u0f3i,16-hydroxy hexadecanoic acid
IUPAC Name	16-hydroxyhexadecanoic acid
InChI Key	UGAGPNKCDRTDHP-UHFFFAOYSA-N
Molecular Formula	C16H32O3

Hexafluoroglutaric acid, 98%

CAS: 376-73-8 Molecular Formula: C5H2F6O4 Molecular Weight (g/mol): 240.06 MDL Number: MFCD00004172 InChI Key: CCUWGJDGLACFQT-UHFFFAOYSA-N Synonym: hexafluoroglutaric acid,perfluoroglutaric acid,hexafluoropentanedioic acid,pentanedioic acid, hexafluoro,glutaric acid, hexafluoro,pentanedioic acid, 2,2,3,3,4,4-hexafluoro,acmc-209iut,perfluoropentanedioic acid,glutaric acid, hexafluoro-8ci PubChem CID: 67827 SMILES: OC(=O)C(F)(F)C(F)(F)C(F)(F)C(O)=O

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Specifications

PubChem CID	67827
CAS	376-73-8
Molecular Weight (g/mol)	240.06
MDL Number	MFCD00004172
SMILES	OC(=O)C(F)(F)C(F)(F)C(F)(F)C(O)=O
Synonym	hexafluoroglutaric acid,perfluoroglutaric acid,hexafluoropentanedioic acid,pentanedioic acid, hexafluoro,glutaric acid, hexafluoro,pentanedioic acid, 2,2,3,3,4,4-hexafluoro,acmc-209iut,perfluoropentanedioic acid,glutaric acid, hexafluoro-8ci
InChI Key	CCUWGJDGLACFQT-UHFFFAOYSA-N
Molecular Formula	C5H2F6O4

Fatty acid conjugates

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