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.

136 – 150 of 1,635 results

136

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

137

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

138

5-Hexenoic acid, 99%

CAS: 1577-22-6 Molecular Formula: C6H10O2 Molecular Weight (g/mol): 114.144 MDL Number: MFCD00046558 InChI Key: XUDOZULIAWNMIU-UHFFFAOYSA-N Synonym: 5-hexenoic acid,delta-hexenoic acid,acmc-1bnq8 PubChem CID: 15308 IUPAC Name: hex-5-enoic acid SMILES: C=CCCCC(=O)O

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Specifications

PubChem CID	15308
CAS	1577-22-6
Molecular Weight (g/mol)	114.144
MDL Number	MFCD00046558
SMILES	C=CCCCC(=O)O
Synonym	5-hexenoic acid,delta-hexenoic acid,acmc-1bnq8
IUPAC Name	hex-5-enoic acid
InChI Key	XUDOZULIAWNMIU-UHFFFAOYSA-N
Molecular Formula	C6H10O2

139

3,5,5-Trimethylhexanoic acid, 97%

CAS: 3302-10-1 Molecular Formula: C9H18O2 Molecular Weight (g/mol): 158.24 MDL Number: MFCD00020507 InChI Key: OILUAKBAMVLXGF-UHFFFAOYNA-N Synonym: hexanoic acid, 3,5,5-trimethyl,3,5,5-trimethyl-hexanoic acid,3,5,5-trimethylhexanoicacid,unii-aw943q219o,acmc-1assi,dsstox_cid_9254,3,5-trimethylhexanoic acid,dsstox_rid_78735,dsstox_gsid_29254,3,5,5 trimethylhexanoic acid PubChem CID: 90960 IUPAC Name: 3,5,5-trimethylhexanoic acid SMILES: CC(CC(=O)O)CC(C)(C)C

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Specifications

PubChem CID	90960
CAS	3302-10-1
Molecular Weight (g/mol)	158.24
MDL Number	MFCD00020507
SMILES	CC(CC(=O)O)CC(C)(C)C
Synonym	hexanoic acid, 3,5,5-trimethyl,3,5,5-trimethyl-hexanoic acid,3,5,5-trimethylhexanoicacid,unii-aw943q219o,acmc-1assi,dsstox_cid_9254,3,5-trimethylhexanoic acid,dsstox_rid_78735,dsstox_gsid_29254,3,5,5 trimethylhexanoic acid
IUPAC Name	3,5,5-trimethylhexanoic acid
InChI Key	OILUAKBAMVLXGF-UHFFFAOYNA-N
Molecular Formula	C9H18O2

140

5H-Perfluoropentanoic acid, 96%

CAS: 376-72-7 Molecular Formula: C5H2F8O2 Molecular Weight (g/mol): 246.056 MDL Number: MFCD00054690 InChI Key: VGFKXVSMDOKOJZ-UHFFFAOYSA-N Synonym: 5h-octafluoropentanoic acid,octafluoropentanoic acid,2,2,3,3,4,4,5,5-octafluorovaleric acid,5h-perfluoropentanoic acid,omega-h-oktafluorpentansaeure german,pentanoic acid, 2,2,3,3,4,4,5,5-octafluoro,omega-h-oktafluorpentansaeure,5-h-octafluoropentanoic acid,4-02-00-00877 beilstein handbook reference PubChem CID: 120227 IUPAC Name: 2,2,3,3,4,4,5,5-octafluoropentanoic acid SMILES: C(C(C(C(C(=O)O)(F)F)(F)F)(F)F)(F)F

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Specifications

PubChem CID	120227
CAS	376-72-7
Molecular Weight (g/mol)	246.056
MDL Number	MFCD00054690
SMILES	C(C(C(C(C(=O)O)(F)F)(F)F)(F)F)(F)F
Synonym	5h-octafluoropentanoic acid,octafluoropentanoic acid,2,2,3,3,4,4,5,5-octafluorovaleric acid,5h-perfluoropentanoic acid,omega-h-oktafluorpentansaeure german,pentanoic acid, 2,2,3,3,4,4,5,5-octafluoro,omega-h-oktafluorpentansaeure,5-h-octafluoropentanoic acid,4-02-00-00877 beilstein handbook reference
IUPAC Name	2,2,3,3,4,4,5,5-octafluoropentanoic acid
InChI Key	VGFKXVSMDOKOJZ-UHFFFAOYSA-N
Molecular Formula	C5H2F8O2

141

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

142

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

143

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

144

Elaidic acid, 98%

CAS: 112-79-8 Molecular Formula: C18H34O2 Molecular Weight (g/mol): 282.468 MDL Number: MFCD00063954 InChI Key: ZQPPMHVWECSIRJ-MDZDMXLPSA-N Synonym: elaidic acid,trans-oleic acid,trans-9-octadecenoic acid,9-octadecenoic acid,e-oleic acid,9-octadecenoic acid, e,e-octadec-9-enoic acid,trans-elaidic acid,9-octadecenoic acid, 9e,elaidinsaure PubChem CID: 637517 ChEBI: CHEBI:27997 IUPAC Name: (E)-octadec-9-enoic acid SMILES: CCCCCCCCC=CCCCCCCCC(=O)O

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Specifications

PubChem CID	637517
CAS	112-79-8
Molecular Weight (g/mol)	282.468
ChEBI	CHEBI:27997
MDL Number	MFCD00063954
SMILES	CCCCCCCCC=CCCCCCCCC(=O)O
Synonym	elaidic acid,trans-oleic acid,trans-9-octadecenoic acid,9-octadecenoic acid,e-oleic acid,9-octadecenoic acid, e,e-octadec-9-enoic acid,trans-elaidic acid,9-octadecenoic acid, 9e,elaidinsaure
IUPAC Name	(E)-octadec-9-enoic acid
InChI Key	ZQPPMHVWECSIRJ-MDZDMXLPSA-N
Molecular Formula	C18H34O2

145

trans-2-Hexenoic acid, 96%

CAS: 13419-69-7 Molecular Formula: C6H9O2 Molecular Weight (g/mol): 113.14 MDL Number: MFCD00002705 InChI Key: NIONDZDPPYHYKY-SNAWJCMRSA-M Synonym: trans-2-hexenoic acid,2-hexenoic acid,e-hex-2-enoic acid,hex-2-enoic acid,trans-hex-2-enoic acid,e-2-hexenoic acid,hexenoic acid,2e-hex-2-enoic acid,2-hexenoic acid, 2e,2-hexenoic acid, e PubChem CID: 5282707 ChEBI: CHEBI:87721 IUPAC Name: (E)-hex-2-enoic acid SMILES: CCC\C=C\C([O-])=O

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Specifications

PubChem CID	5282707
CAS	13419-69-7
Molecular Weight (g/mol)	113.14
ChEBI	CHEBI:87721
MDL Number	MFCD00002705
SMILES	CCC\C=C\C([O-])=O
Synonym	trans-2-hexenoic acid,2-hexenoic acid,e-hex-2-enoic acid,hex-2-enoic acid,trans-hex-2-enoic acid,e-2-hexenoic acid,hexenoic acid,2e-hex-2-enoic acid,2-hexenoic acid, 2e,2-hexenoic acid, e
IUPAC Name	(E)-hex-2-enoic acid
InChI Key	NIONDZDPPYHYKY-SNAWJCMRSA-M
Molecular Formula	C6H9O2

146

Yttrium(III) 2-ethylhexanoate, 99.8% (metals basis)

CAS: 103470-68-4 Molecular Formula: C24H45O6Y Molecular Weight (g/mol): 518.524 MDL Number: MFCD00070441 InChI Key: AGOMHFKGCMKLDA-UHFFFAOYSA-K Synonym: yttrium iii 2-ethylhexanoate,yttrium 2-ethylhexanoate,hexanoic acid,2-ethyl-, yttrium 3+ salt 3:1,yttrium iii 2-ethylhexanoate w/v in n-hexane,acmc-1c5ry,yttrium tri 2-ethylhexanoate,yttrium tris 2-ethylhexanoate,tris 2-ethylhexanoic acid yttrium salt,yttrium 3+ tris 2-ethylhexanoate,yttrium iii 2-ethylhexanoate y PubChem CID: 15607674 IUPAC Name: 2-ethylhexanoate;yttrium(3+) SMILES: CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Y+3]

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Specifications

PubChem CID	15607674
CAS	103470-68-4
Molecular Weight (g/mol)	518.524
MDL Number	MFCD00070441
SMILES	CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Y+3]
Synonym	yttrium iii 2-ethylhexanoate,yttrium 2-ethylhexanoate,hexanoic acid,2-ethyl-, yttrium 3+ salt 3:1,yttrium iii 2-ethylhexanoate w/v in n-hexane,acmc-1c5ry,yttrium tri 2-ethylhexanoate,yttrium tris 2-ethylhexanoate,tris 2-ethylhexanoic acid yttrium salt,yttrium 3+ tris 2-ethylhexanoate,yttrium iii 2-ethylhexanoate y
IUPAC Name	2-ethylhexanoate;yttrium(3+)
InChI Key	AGOMHFKGCMKLDA-UHFFFAOYSA-K
Molecular Formula	C24H45O6Y

147

Calcium 2-ethylhexanoate, Superconductor Grade, in 2-ethylhexanoic acid (3-8% Ca)

CAS: 136-51-6 Molecular Formula: C16H30CaO4 Molecular Weight (g/mol): 326.49 MDL Number: MFCD00014001 InChI Key: LTPCXXMGKDQPAO-UHFFFAOYSA-L Synonym: calcium 2-ethylhexanoate,calcium bis 2-ethylhexanoate,hexanoic acid, 2-ethyl-, calcium salt,hexanoic acid, 2-ethyl-, calcium salt 2:1,calcium 2-ethyl-hexanoate,octope ca,calcium hex-cem,nikka octhix calcium,calcium 2-ethylhexoate,dsstox_cid_7063 PubChem CID: 61082 IUPAC Name: calcium;2-ethylhexanoate SMILES: CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Ca+2]

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Specifications

PubChem CID	61082
CAS	136-51-6
Molecular Weight (g/mol)	326.49
MDL Number	MFCD00014001
SMILES	CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Ca+2]
Synonym	calcium 2-ethylhexanoate,calcium bis 2-ethylhexanoate,hexanoic acid, 2-ethyl-, calcium salt,hexanoic acid, 2-ethyl-, calcium salt 2:1,calcium 2-ethyl-hexanoate,octope ca,calcium hex-cem,nikka octhix calcium,calcium 2-ethylhexoate,dsstox_cid_7063
IUPAC Name	calcium;2-ethylhexanoate
InChI Key	LTPCXXMGKDQPAO-UHFFFAOYSA-L
Molecular Formula	C16H30CaO4

148

MilliporeSigma™ InSolution™ Sinefungin, Calbiochem™,

CAS: 58944-73-3 Molecular Formula: C15H23N7O5 Molecular Weight (g/mol): 381.393 InChI Key: LMXOHSDXUQEUSF-LWCRYBRRSA-N Synonym: insolution sinefungin,2,5-diamino-6-2r,3s,4r,5r-5-6-aminopurin-9-yl-3,4-dihydroxyoxolan-2-yl hexanoic acid,antibiotic 32232rp,compound-57926 PubChem CID: 6917665 IUPAC Name: 2,5-diamino-6-[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]hexanoic acid SMILES: C1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)CC(CCC(C(=O)O)N)N)O)O

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Specifications

PubChem CID	6917665
CAS	58944-73-3
Molecular Weight (g/mol)	381.393
SMILES	C1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)CC(CCC(C(=O)O)N)N)O)O
Synonym	insolution sinefungin,2,5-diamino-6-2r,3s,4r,5r-5-6-aminopurin-9-yl-3,4-dihydroxyoxolan-2-yl hexanoic acid,antibiotic 32232rp,compound-57926
IUPAC Name	2,5-diamino-6-[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]hexanoic acid
InChI Key	LMXOHSDXUQEUSF-LWCRYBRRSA-N
Molecular Formula	C15H23N7O5

149

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

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

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Specifications

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

150

Retinoic acid, 99.85%, MP Biomedicals™

CAS: 302-79-4 Molecular Formula: C20H28O2 Molecular Weight (g/mol): 300.44 MDL Number: MFCD00001551 InChI Key: SHGAZHPCJJPHSC-YCNIQYBTSA-N Synonym: retinoic acid,tretinoin,vitamin a acid,all-trans-retinoic acid,trans-retinoic acid,renova,airol,retin-a,vesanoid,atra PubChem CID: 444795 ChEBI: CHEBI:15367 IUPAC Name: (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoic acid SMILES: C\C(\C=C\C1=C(C)CCCC1(C)C)=C/C=C/C(/C)=C/C(O)=O

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Specifications

PubChem CID	444795
CAS	302-79-4
Molecular Weight (g/mol)	300.44
ChEBI	CHEBI:15367
MDL Number	MFCD00001551
SMILES	C\C(\C=C\C1=C(C)CCCC1(C)C)=C/C=C/C(/C)=C/C(O)=O
Synonym	retinoic acid,tretinoin,vitamin a acid,all-trans-retinoic acid,trans-retinoic acid,renova,airol,retin-a,vesanoid,atra
IUPAC Name	(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoic acid
InChI Key	SHGAZHPCJJPHSC-YCNIQYBTSA-N
Molecular Formula	C20H28O2

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