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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166 – 180 of 2,421 results

166

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N-Boc-3-cyclohexyl-L-alanine, 98%

CAS: 37736-82-6 Molecular Formula: C14H25NO4 Molecular Weight (g/mol): 271.357 MDL Number: MFCD00211335 InChI Key: MSZQAQJBXGTSHP-NSHDSACASA-N Synonym: boc-cha-oh,boc-cha-oh hydrate,s-2-tert-butoxycarbonyl amino-3-cyclohexylpropanoic acid,boc-beta-cyclohexyl-ala-oh,boc-l-cyclohexylalanine,s-2-tert-butoxycarbonylamino-3-cyclohexyl-propionic acid,n-boc-b-cyclohexylalanine,2s-2-tert-butoxycarbonyl amino-3-cyclohexylpropanoic acid,boc-cyclohexyl-ala-oh,boc-3-cyclohexyl-l-alanine PubChem CID: 10588189 IUPAC Name: (2S)-3-cyclohexyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid SMILES: CC(C)(C)OC(=O)NC(CC1CCCCC1)C(=O)O

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Specifications

PubChem CID	10588189
CAS	37736-82-6
Molecular Weight (g/mol)	271.357
MDL Number	MFCD00211335
SMILES	CC(C)(C)OC(=O)NC(CC1CCCCC1)C(=O)O
Synonym	boc-cha-oh,boc-cha-oh hydrate,s-2-tert-butoxycarbonyl amino-3-cyclohexylpropanoic acid,boc-beta-cyclohexyl-ala-oh,boc-l-cyclohexylalanine,s-2-tert-butoxycarbonylamino-3-cyclohexyl-propionic acid,n-boc-b-cyclohexylalanine,2s-2-tert-butoxycarbonyl amino-3-cyclohexylpropanoic acid,boc-cyclohexyl-ala-oh,boc-3-cyclohexyl-l-alanine
IUPAC Name	(2S)-3-cyclohexyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
InChI Key	MSZQAQJBXGTSHP-NSHDSACASA-N
Molecular Formula	C14H25NO4

167

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Mucochloric acid, 99%

CAS: 87-56-9 Molecular Formula: C4H2Cl2O3 Molecular Weight (g/mol): 168.96 MDL Number: MFCD00006966,MFCD00006966 InChI Key: LUMLZKVIXLWTCI-IHWYPQMZSA-N Synonym: mucochloric acid,2,3-dichloromaleic aldehyde acid,kyselina mukochlorova,2z-2,3-dichloro-4-oxobut-2-enoic acid,2-butenoic acid, 2,3-dichloro-4-oxo-, 2z,aldehydodichloromaleic acid,dichloromalealdehydic acid,unii-5i5877jhiw,kyselina mukochlorova czech,ccris 6597 PubChem CID: 2771871 IUPAC Name: (Z)-2,3-dichloro-4-oxobut-2-enoic acid SMILES: OC(=O)C(\Cl)=C(\Cl)C=O

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PubChem CID	2771871
CAS	87-56-9
Molecular Weight (g/mol)	168.96
MDL Number	MFCD00006966,MFCD00006966
SMILES	OC(=O)C(\Cl)=C(\Cl)C=O
Synonym	mucochloric acid,2,3-dichloromaleic aldehyde acid,kyselina mukochlorova,2z-2,3-dichloro-4-oxobut-2-enoic acid,2-butenoic acid, 2,3-dichloro-4-oxo-, 2z,aldehydodichloromaleic acid,dichloromalealdehydic acid,unii-5i5877jhiw,kyselina mukochlorova czech,ccris 6597
IUPAC Name	(Z)-2,3-dichloro-4-oxobut-2-enoic acid
InChI Key	LUMLZKVIXLWTCI-IHWYPQMZSA-N
Molecular Formula	C4H2Cl2O3

168

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

169

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Mucobromic acid, 99+%

CAS: 488-11-9 Molecular Formula: C₄H₂Br₂O₃ Molecular Weight (g/mol): 257.86 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)	257.86
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	C₄H₂Br₂O₃

170

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2-Hydroxy-4-methylvaleric acid, 98%

CAS: 498-36-2 Molecular Formula: C6H12O3 Molecular Weight (g/mol): 132.159 MDL Number: MFCD00004246 InChI Key: LVRFTAZAXQPQHI-UHFFFAOYSA-N Synonym: 2-hydroxy-4-methylvaleric acid,2-hydroxyisocaproic acid,leucic acid,dl-leucic acid,alpha-hydroxyisocaproic acid,leucinic acid,2-hydroxy-4-methyl-pentanoic acid,pentanoic acid, 2-hydroxy-4-methyl,dl-2-hydroxyisocaproic acid,leucate PubChem CID: 92779 ChEBI: CHEBI:59783 IUPAC Name: 2-hydroxy-4-methylpentanoic acid SMILES: CC(C)CC(C(=O)O)O

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Specifications

PubChem CID	92779
CAS	498-36-2
Molecular Weight (g/mol)	132.159
ChEBI	CHEBI:59783
MDL Number	MFCD00004246
SMILES	CC(C)CC(C(=O)O)O
Synonym	2-hydroxy-4-methylvaleric acid,2-hydroxyisocaproic acid,leucic acid,dl-leucic acid,alpha-hydroxyisocaproic acid,leucinic acid,2-hydroxy-4-methyl-pentanoic acid,pentanoic acid, 2-hydroxy-4-methyl,dl-2-hydroxyisocaproic acid,leucate
IUPAC Name	2-hydroxy-4-methylpentanoic acid
InChI Key	LVRFTAZAXQPQHI-UHFFFAOYSA-N
Molecular Formula	C6H12O3

171

9,10-Dihydroxystearic Acid, Pract., MP Biomedicals

CAS: 120-87-6 Molecular Formula: C18H36O4 Molecular Weight (g/mol): 316.48 MDL Number: MFCD00046726 InChI Key: VACHUYIREGFMSP-IAGOWNOFSA-N Synonym: 9,10-dihydroxystearic acid,dioxystearinsaeure,9,10-dihydroxystearate,9,10-dihydroxystearinsaeure,9,10-dihydroxy-octadecanoic acid,rac threo-9,10-dihydroxystearic acid,dhsa,parent,9,10-dihydroxy stearic acid,9,10-dhsa PubChem CID: 89377 ChEBI: CHEBI:28724 IUPAC Name: (9R,10R)-9,10-dihydroxyoctadecanoic acid SMILES: CCCCCCCC[C@@H](O)[C@H](O)CCCCCCCC(O)=O

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Specifications

PubChem CID	89377
CAS	120-87-6
Molecular Weight (g/mol)	316.48
ChEBI	CHEBI:28724
MDL Number	MFCD00046726
SMILES	CCCCCCCC[C@@H](O)[C@H](O)CCCCCCCC(O)=O
Synonym	9,10-dihydroxystearic acid,dioxystearinsaeure,9,10-dihydroxystearate,9,10-dihydroxystearinsaeure,9,10-dihydroxy-octadecanoic acid,rac threo-9,10-dihydroxystearic acid,dhsa,parent,9,10-dihydroxy stearic acid,9,10-dhsa
IUPAC Name	(9R,10R)-9,10-dihydroxyoctadecanoic acid
InChI Key	VACHUYIREGFMSP-IAGOWNOFSA-N
Molecular Formula	C18H36O4

172

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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

173

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5-(4-Fluorophenyl)valeric acid, 97%

CAS: 24484-22-8 Molecular Formula: C11H12FO2 Molecular Weight (g/mol): 195.21 MDL Number: MFCD00800242 InChI Key: BXEFPLJKYWEEAN-UHFFFAOYSA-M PubChem CID: 2734670 IUPAC Name: 5-(4-fluorophenyl)pentanoic acid SMILES: [O-]C(=O)CCCCC1=CC=C(F)C=C1

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Specifications

PubChem CID	2734670
CAS	24484-22-8
Molecular Weight (g/mol)	195.21
MDL Number	MFCD00800242
SMILES	[O-]C(=O)CCCCC1=CC=C(F)C=C1
IUPAC Name	5-(4-fluorophenyl)pentanoic acid
InChI Key	BXEFPLJKYWEEAN-UHFFFAOYSA-M
Molecular Formula	C11H12FO2

174

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(S)-4-Amino-2-(Boc-amino)butyric acid, 97%

CAS: 25691-37-6 Molecular Formula: C9H18N2O4 Molecular Weight (g/mol): 218.253 MDL Number: MFCD00236841 InChI Key: MDCPCLPRWLKUIQ-LURJTMIESA-N Synonym: boc-l-2,4-diaminobutyric acid,boc-dab-oh,s-4-amino-2-tert-butoxycarbonyl amino butanoic acid,s-4-amino-2-tert-butoxycarbonylamino butanoic acid,n2-boc-s-2,4-diamino-butanoic acid,s-4-amino-2-boc-amino butyric acid,2s-4-amino-2-tert-butoxycarbonyl amino butanoic acid,n-boc-s-2,4-diamino-butanoic acid,butanoic acid, 4-amino-2-1,1-dimethylethoxy carbonyl amino-, 2s,s-4-amino-2-tert-butoxycarbonylamino butyric acid PubChem CID: 7019666 IUPAC Name: (2S)-4-amino-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid SMILES: CC(C)(C)OC(=O)NC(CCN)C(=O)O

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Specifications

PubChem CID	7019666
CAS	25691-37-6
Molecular Weight (g/mol)	218.253
MDL Number	MFCD00236841
SMILES	CC(C)(C)OC(=O)NC(CCN)C(=O)O
Synonym	boc-l-2,4-diaminobutyric acid,boc-dab-oh,s-4-amino-2-tert-butoxycarbonyl amino butanoic acid,s-4-amino-2-tert-butoxycarbonylamino butanoic acid,n2-boc-s-2,4-diamino-butanoic acid,s-4-amino-2-boc-amino butyric acid,2s-4-amino-2-tert-butoxycarbonyl amino butanoic acid,n-boc-s-2,4-diamino-butanoic acid,butanoic acid, 4-amino-2-1,1-dimethylethoxy carbonyl amino-, 2s,s-4-amino-2-tert-butoxycarbonylamino butyric acid
IUPAC Name	(2S)-4-amino-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid
InChI Key	MDCPCLPRWLKUIQ-LURJTMIESA-N
Molecular Formula	C9H18N2O4

175

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4-Pentynoic acid, 95%

CAS: 6089-09-4 Molecular Formula: C₅H₆O₂ Molecular Weight (g/mol): 98.1 MDL Number: MFCD00004407 InChI Key: MLBYLEUJXUBIJJ-UHFFFAOYSA-M Synonym: 4-pentynoic acid,propargylacetic acid,pent-4-yn-1-oic acid,4-pentynoicacid,pent4-ynoic acid,zlchem 796,pubchem3491,pent-4-yn-oic acid,acmc-1az7d PubChem CID: 22464 IUPAC Name: pent-4-ynoic acid SMILES: C#CCCC(=O)O

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Specifications

PubChem CID	22464
CAS	6089-09-4
Molecular Weight (g/mol)	98.1
MDL Number	MFCD00004407
SMILES	C#CCCC(=O)O
Synonym	4-pentynoic acid,propargylacetic acid,pent-4-yn-1-oic acid,4-pentynoicacid,pent4-ynoic acid,zlchem 796,pubchem3491,pent-4-yn-oic acid,acmc-1az7d
IUPAC Name	pent-4-ynoic acid
InChI Key	MLBYLEUJXUBIJJ-UHFFFAOYSA-M
Molecular Formula	C₅H₆O₂

176

Barium 2-ethylhexanoate, 20% w/w in 2-ethylhexanoic acid, Thermo Scientific™

CAS: 2457-01-4 MDL Number: MFCD00058696

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Specifications

CAS	2457-01-4
MDL Number	MFCD00058696

177

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5-Bromovaleric acid, 97%

CAS: 2067-33-6 Molecular Formula: C₅H₉BrO₂ Molecular Weight (g/mol): 181.03 MDL Number: MFCD00004414 InChI Key: WNXNUPJZWYOKMW-UHFFFAOYSA-N Synonym: 5-bromovaleric acid,pentanoic acid, 5-bromo,5-bromo-n-valeric acid,valeric acid, 5-bromo,5-bromovalenc acid,1-bromo-4-carboxybutane,.delta.-bromovaleric acid,delta-bromovaleric acid,5-bromo valeric acid,5-bromoval eric acid PubChem CID: 16368 IUPAC Name: 5-bromopentanoic acid SMILES: C(CCBr)CC(=O)O

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PubChem CID	16368
CAS	2067-33-6
Molecular Weight (g/mol)	181.03
MDL Number	MFCD00004414
SMILES	C(CCBr)CC(=O)O
Synonym	5-bromovaleric acid,pentanoic acid, 5-bromo,5-bromo-n-valeric acid,valeric acid, 5-bromo,5-bromovalenc acid,1-bromo-4-carboxybutane,.delta.-bromovaleric acid,delta-bromovaleric acid,5-bromo valeric acid,5-bromoval eric acid
IUPAC Name	5-bromopentanoic acid
InChI Key	WNXNUPJZWYOKMW-UHFFFAOYSA-N
Molecular Formula	C₅H₉BrO₂

178

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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

179

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Palmitic acid, sodium salt, 98%

CAS: 408-35-5 Molecular Formula: C₁₆H₃₁NaO₂ Molecular Weight (g/mol): 278.4 MDL Number: MFCD00002749 InChI Key: GGXKEBACDBNFAF-UHFFFAOYSA-M Synonym: sodium palmitate,palmitic acid sodium salt,hexadecanoic acid, sodium salt,sodium hexadecanoate,palmitic acid, sodium salt,sodium pentadecanecarboxylate,unii-jq43kp6296,hsdb 759,hexadecanoic acid sodium salt,hexadecanoic acid,sodium salt 1:1 PubChem CID: 2735111 IUPAC Name: sodium;hexadecanoate SMILES: CCCCCCCCCCCCCCCC(=O)[O-].[Na+]

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Specifications

PubChem CID	2735111
CAS	408-35-5
Molecular Weight (g/mol)	278.4
MDL Number	MFCD00002749
SMILES	CCCCCCCCCCCCCCCC(=O)[O-].[Na+]
Synonym	sodium palmitate,palmitic acid sodium salt,hexadecanoic acid, sodium salt,sodium hexadecanoate,palmitic acid, sodium salt,sodium pentadecanecarboxylate,unii-jq43kp6296,hsdb 759,hexadecanoic acid sodium salt,hexadecanoic acid,sodium salt 1:1
IUPAC Name	sodium;hexadecanoate
InChI Key	GGXKEBACDBNFAF-UHFFFAOYSA-M
Molecular Formula	C₁₆H₃₁NaO₂

180

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2-Methylheptanoic acid, 98%

CAS: 1188-02-9 Molecular Formula: C8H16O2 Molecular Weight (g/mol): 144.214 MDL Number: MFCD00142944 InChI Key: NKBWMBRPILTCRD-UHFFFAOYSA-N Synonym: 2-methylenanthic acid,heptanoic acid, 2-methyl,methylamylacetic acid,2-methyl-heptanoic acid,heptanoic acid, methyl,alpha-methylheptanoic acid,2-methyl heptanoic acid,heptane-2-carboxylic acid,fema no. 2706,heptanoic acid, 2-methyl-, 2s PubChem CID: 14475 IUPAC Name: 2-methylheptanoic acid SMILES: CCCCCC(C)C(=O)O

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Specifications

PubChem CID	14475
CAS	1188-02-9
Molecular Weight (g/mol)	144.214
MDL Number	MFCD00142944
SMILES	CCCCCC(C)C(=O)O
Synonym	2-methylenanthic acid,heptanoic acid, 2-methyl,methylamylacetic acid,2-methyl-heptanoic acid,heptanoic acid, methyl,alpha-methylheptanoic acid,2-methyl heptanoic acid,heptane-2-carboxylic acid,fema no. 2706,heptanoic acid, 2-methyl-, 2s
IUPAC Name	2-methylheptanoic acid
InChI Key	NKBWMBRPILTCRD-UHFFFAOYSA-N
Molecular Formula	C8H16O2

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