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 565 results

Nonadecanoic acid, 98+%

CAS: 646-30-0 Molecular Formula: C₁₉H₃₈O₂ Molecular Weight (g/mol): 298.51 MDL Number: MFCD00002754 InChI Key: ISYWECDDZWTKFF-UHFFFAOYSA-N Synonym: n-nonadecanoic acid,nonadecylic acid,unii-h6m3vyc62p,h6m3vyc62p,fatty acids, c16-22,n-nonadecanoate,n-nonadecylate,nonadecyclic acid,c16-c22 alkylcarboxylic acid PubChem CID: 12591 ChEBI: CHEBI:39246 IUPAC Name: nonadecanoic acid SMILES: CCCCCCCCCCCCCCCCCCC(=O)O

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Specifications

PubChem CID	12591
CAS	646-30-0
Molecular Weight (g/mol)	298.51
ChEBI	CHEBI:39246
MDL Number	MFCD00002754
SMILES	CCCCCCCCCCCCCCCCCCC(=O)O
Synonym	n-nonadecanoic acid,nonadecylic acid,unii-h6m3vyc62p,h6m3vyc62p,fatty acids, c16-22,n-nonadecanoate,n-nonadecylate,nonadecyclic acid,c16-c22 alkylcarboxylic acid
IUPAC Name	nonadecanoic acid
InChI Key	ISYWECDDZWTKFF-UHFFFAOYSA-N
Molecular Formula	C₁₉H₃₈O₂

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

Zirconium(IV) oxide 2-ethylhexanoate, in mineral spirits (≈6% Zr), Thermo Scientific Chemicals

CAS: 22464-99-9 Molecular Formula: C8H16O2Zr Molecular Weight (g/mol): 235.438 MDL Number: MFCD00072684 InChI Key: HBHXRPHNNKAWQL-UHFFFAOYSA-N Synonym: zirconium 2-ethylhexanoate PubChem CID: 73555628 IUPAC Name: 2-ethylhexanoic acid;zirconium SMILES: CCCCC(CC)C(=O)O.[Zr]

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Specifications

PubChem CID	73555628
CAS	22464-99-9
Molecular Weight (g/mol)	235.438
MDL Number	MFCD00072684
SMILES	CCCCC(CC)C(=O)O.[Zr]
Synonym	zirconium 2-ethylhexanoate
IUPAC Name	2-ethylhexanoic acid;zirconium
InChI Key	HBHXRPHNNKAWQL-UHFFFAOYSA-N
Molecular Formula	C8H16O2Zr

Barium 2-ethylhexanoate in 2-ethylhexanoic acid, Ba ca 17.5%

CAS: 2457-01-4 Molecular Formula: C16H30BaO4 Molecular Weight (g/mol): 423.74 MDL Number: MFCD00058696 InChI Key: VJFFDDQGMMQGTQ-UHFFFAOYNA-L Synonym: barium 2-ethylhexanoate,barium bis 2-ethylhexanoate,barium 2+ ; 2-ethylhexanoate,hexanoic acid, 2-ethyl-, barium salt 2:1,acmc-20alrk,hexanoic acid, 2-ethyl-, barium salt,dsstox_cid_24888,dsstox_rid_80561,dsstox_gsid_44888,bis 2-ethylhexanoic acid barium salt PubChem CID: 102821 IUPAC Name: barium(2+);2-ethylhexanoate SMILES: CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Ba+2]

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Specifications

PubChem CID	102821
CAS	2457-01-4
Molecular Weight (g/mol)	423.74
MDL Number	MFCD00058696
SMILES	CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Ba+2]
Synonym	barium 2-ethylhexanoate,barium bis 2-ethylhexanoate,barium 2+ ; 2-ethylhexanoate,hexanoic acid, 2-ethyl-, barium salt 2:1,acmc-20alrk,hexanoic acid, 2-ethyl-, barium salt,dsstox_cid_24888,dsstox_rid_80561,dsstox_gsid_44888,bis 2-ethylhexanoic acid barium salt
IUPAC Name	barium(2+);2-ethylhexanoate
InChI Key	VJFFDDQGMMQGTQ-UHFFFAOYNA-L
Molecular Formula	C16H30BaO4

Pimelic acid, 98%

CAS: 111-16-0 Molecular Formula: C7H12O4 Molecular Weight (g/mol): 160.17 MDL Number: MFCD00004425 InChI Key: WLJVNTCWHIRURA-UHFFFAOYSA-N Synonym: pimelic acid,1,5-pentanedicarboxylic acid,pileric acid,heptandioic acid,heptane-1,7-dioic acid,pimelate,6-carboxyhexanoate,6-carboxyhexanoic acid,1,7-heptanedioic acid,unii-bzq96wx25f PubChem CID: 385 ChEBI: CHEBI:30531 IUPAC Name: heptanedioic acid SMILES: OC(=O)CCCCCC(O)=O

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Specifications

PubChem CID	385
CAS	111-16-0
Molecular Weight (g/mol)	160.17
ChEBI	CHEBI:30531
MDL Number	MFCD00004425
SMILES	OC(=O)CCCCCC(O)=O
Synonym	pimelic acid,1,5-pentanedicarboxylic acid,pileric acid,heptandioic acid,heptane-1,7-dioic acid,pimelate,6-carboxyhexanoate,6-carboxyhexanoic acid,1,7-heptanedioic acid,unii-bzq96wx25f
IUPAC Name	heptanedioic acid
InChI Key	WLJVNTCWHIRURA-UHFFFAOYSA-N
Molecular Formula	C7H12O4

Sodium fumarate, 98%

CAS: 17013-01-3 Molecular Formula: C₄H₂Na₂O₄ Molecular Weight (g/mol): 160.04 MDL Number: MFCD00064567 InChI Key: VXXVUHAXJHEYFH-SEPHDYHBSA-N Synonym: disodium fumarate,sodium fumarate,sodium fumarate dibasic,fumaric acid, disodium salt,fumaric acid disodium salt,fumaran sodny czech,fumaran sodny,disodium butenedioate,di-sodium fumarate,sodium monofumarate PubChem CID: 87110070 IUPAC Name: (E)-but-2-enedioic acid;sodium SMILES: C(=CC(=O)O)C(=O)O.[Na].[Na]

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Specifications

PubChem CID	87110070
CAS	17013-01-3
Molecular Weight (g/mol)	160.04
MDL Number	MFCD00064567
SMILES	C(=CC(=O)O)C(=O)O.[Na].[Na]
Synonym	disodium fumarate,sodium fumarate,sodium fumarate dibasic,fumaric acid, disodium salt,fumaric acid disodium salt,fumaran sodny czech,fumaran sodny,disodium butenedioate,di-sodium fumarate,sodium monofumarate
IUPAC Name	(E)-but-2-enedioic acid;sodium
InChI Key	VXXVUHAXJHEYFH-SEPHDYHBSA-N
Molecular Formula	C₄H₂Na₂O₄

L-alpha-Hydroxyisocaproic acid, 98%

CAS: 13748-90-8 Molecular Formula: C₆H₁₂O₃ Molecular Weight (g/mol): 132.16 InChI Key: LVRFTAZAXQPQHI-YFKPBYRVSA-N Synonym: l-leucic acid,s-2-hydroxy-4-methylpentanoic acid,2s-2-hydroxy-4-methylpentanoic acid,l-2-hydroxy-4-methylvaleric acid,s-leucic acid,s-2-hydroxy-4-methylvaleric acid,l-2-hydroxyisocaproic acid,l-alpha-hydroxyisocaproic acid,s---2-hydroxyisocaproic acid,pentanoic acid, 2-hydroxy-4-methyl-, 2s PubChem CID: 83697 ChEBI: CHEBI:44510 IUPAC Name: (2S)-2-hydroxy-4-methylpentanoic acid SMILES: CC(C)CC(C(=O)O)O

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Specifications

PubChem CID	83697
CAS	13748-90-8
Molecular Weight (g/mol)	132.16
ChEBI	CHEBI:44510
SMILES	CC(C)CC(C(=O)O)O
Synonym	l-leucic acid,s-2-hydroxy-4-methylpentanoic acid,2s-2-hydroxy-4-methylpentanoic acid,l-2-hydroxy-4-methylvaleric acid,s-leucic acid,s-2-hydroxy-4-methylvaleric acid,l-2-hydroxyisocaproic acid,l-alpha-hydroxyisocaproic acid,s---2-hydroxyisocaproic acid,pentanoic acid, 2-hydroxy-4-methyl-, 2s
IUPAC Name	(2S)-2-hydroxy-4-methylpentanoic acid
InChI Key	LVRFTAZAXQPQHI-YFKPBYRVSA-N
Molecular Formula	C₆H₁₂O₃

trans-3-[4-(Boc-amino)cyclohexyl]propionic acid, 97%

CAS: 204245-65-8 Molecular Formula: C14H25NO4 Molecular Weight (g/mol): 271.357 MDL Number: MFCD03844590 InChI Key: WCXYTBUDVLMXND-UHFFFAOYSA-N Synonym: cis-3-4-tert-butoxycarbonylaminocyclohexyl propionic acid,cis-3-4-tert-butoxycarbonylaminocyclohexyl-propionic acid,trans-3-4-tert-butoxycarbonylaminocyclohexyl propionic acid,trans-3-4-tert-butoxycarbonylaminocyclohexyl-propionic acid,3-4-tert-butoxycarbonyl amino cyclohexyl propanoic acid,3-trans-4-tert-butoxycarbonyl amino cyclohexyl propanoic acid,wcxytbudvlmxnd-phimtyicsa-n,wcxytbudvlmxnd-xypyzodxsa-n,3-trans-4-tert-butoxycarbonylamino-cyclohexyl-propionic acid PubChem CID: 10516274 IUPAC Name: 3-[4-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexyl]propanoic acid SMILES: CC(C)(C)OC(=O)NC1CCC(CC1)CCC(=O)O

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Specifications

PubChem CID	10516274
CAS	204245-65-8
Molecular Weight (g/mol)	271.357
MDL Number	MFCD03844590
SMILES	CC(C)(C)OC(=O)NC1CCC(CC1)CCC(=O)O
Synonym	cis-3-4-tert-butoxycarbonylaminocyclohexyl propionic acid,cis-3-4-tert-butoxycarbonylaminocyclohexyl-propionic acid,trans-3-4-tert-butoxycarbonylaminocyclohexyl propionic acid,trans-3-4-tert-butoxycarbonylaminocyclohexyl-propionic acid,3-4-tert-butoxycarbonyl amino cyclohexyl propanoic acid,3-trans-4-tert-butoxycarbonyl amino cyclohexyl propanoic acid,wcxytbudvlmxnd-phimtyicsa-n,wcxytbudvlmxnd-xypyzodxsa-n,3-trans-4-tert-butoxycarbonylamino-cyclohexyl-propionic acid
IUPAC Name	3-[4-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexyl]propanoic acid
InChI Key	WCXYTBUDVLMXND-UHFFFAOYSA-N
Molecular Formula	C14H25NO4

Magnesium stearate

CAS: 557-04-0 Molecular Formula: C36H70MgO4 Molecular Weight (g/mol): 591.257 MDL Number: MFCD00036391 InChI Key: HQKMJHAJHXVSDF-UHFFFAOYSA-L Synonym: magnesium stearate,magnesium octadecanoate,magnesium distearate,synpro 90,octadecanoic acid, magnesium salt,dibasic magnesium stearate,petrac mg 20nf,ns-m salt,sm-p,stearic acid, magnesium salt PubChem CID: 11177 ChEBI: CHEBI:9254 IUPAC Name: magnesium;octadecanoate SMILES: CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].[Mg+2]

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Specifications

PubChem CID	11177
CAS	557-04-0
Molecular Weight (g/mol)	591.257
ChEBI	CHEBI:9254
MDL Number	MFCD00036391
SMILES	CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].[Mg+2]
Synonym	magnesium stearate,magnesium octadecanoate,magnesium distearate,synpro 90,octadecanoic acid, magnesium salt,dibasic magnesium stearate,petrac mg 20nf,ns-m salt,sm-p,stearic acid, magnesium salt
IUPAC Name	magnesium;octadecanoate
InChI Key	HQKMJHAJHXVSDF-UHFFFAOYSA-L
Molecular Formula	C36H70MgO4

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

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

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Specifications

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

Lauric acid, sodium salt, 98%

CAS: 629-25-4 Molecular Formula: C12H23NaO2 Molecular Weight (g/mol): 222.30 MDL Number: MFCD00041754 InChI Key: BTURAGWYSMTVOW-UHFFFAOYSA-M Synonym: sodium dodecanoate,sodium laurate,lauric acid sodium salt,dodecanoic acid, sodium salt,lauric acid, sodium salt,dodecanoic acid sodium salt,lauran sodny czech,caswell no. 778a,unii-k146mr5exo,epa pesticide chemical code 079026 PubChem CID: 2735067 IUPAC Name: sodium;dodecanoate SMILES: [Na+].CCCCCCCCCCCC([O-])=O

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Specifications

PubChem CID	2735067
CAS	629-25-4
Molecular Weight (g/mol)	222.30
MDL Number	MFCD00041754
SMILES	[Na+].CCCCCCCCCCCC([O-])=O
Synonym	sodium dodecanoate,sodium laurate,lauric acid sodium salt,dodecanoic acid, sodium salt,lauric acid, sodium salt,dodecanoic acid sodium salt,lauran sodny czech,caswell no. 778a,unii-k146mr5exo,epa pesticide chemical code 079026
IUPAC Name	sodium;dodecanoate
InChI Key	BTURAGWYSMTVOW-UHFFFAOYSA-M
Molecular Formula	C12H23NaO2

trans-2-Pentenoic acid, 97%

CAS: 13991-37-2 Molecular Formula: C5H8O2 Molecular Weight (g/mol): 100.12 MDL Number: MFCD00002704 InChI Key: YIYBQIKDCADOSF-ONEGZZNKSA-N Synonym: trans-2-pentenoic acid,2-pentenoic acid,e-pent-2-enoic acid,pent-2-enoic acid,2e-pent-2-enoic acid,2-pentenoic acid, 2e,beta-ethyl acrylic acid,c2h5ch=chcooh,pentenoic acid,unii-1rg66883cf PubChem CID: 638122 ChEBI: CHEBI:38366 IUPAC Name: (2E)-pent-2-enoic acid SMILES: CC\C=C\C(O)=O

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Specifications

PubChem CID	638122
CAS	13991-37-2
Molecular Weight (g/mol)	100.12
ChEBI	CHEBI:38366
MDL Number	MFCD00002704
SMILES	CC\C=C\C(O)=O
Synonym	trans-2-pentenoic acid,2-pentenoic acid,e-pent-2-enoic acid,pent-2-enoic acid,2e-pent-2-enoic acid,2-pentenoic acid, 2e,beta-ethyl acrylic acid,c2h5ch=chcooh,pentenoic acid,unii-1rg66883cf
IUPAC Name	(2E)-pent-2-enoic acid
InChI Key	YIYBQIKDCADOSF-ONEGZZNKSA-N
Molecular Formula	C5H8O2

4-Pentenoic acid, 98%

CAS: 591-80-0 Molecular Formula: C5H8O2 Molecular Weight (g/mol): 100.12 MDL Number: MFCD00004408 InChI Key: HVAMZGADVCBITI-UHFFFAOYSA-N Synonym: 4-pentenoic acid,allylacetic acid,allyl acetic acid,4 pa,3-vinylpropionic acid,delta 4-pentenoic acid,unii-d4s77y29fb,fema no. 2843,.delta.4-pentenoic acid,wln: qv3u1 PubChem CID: 61138 ChEBI: CHEBI:35936 IUPAC Name: pent-4-enoic acid SMILES: OC(=O)CCC=C

Pricing and Availability
Specifications

PubChem CID	61138
CAS	591-80-0
Molecular Weight (g/mol)	100.12
ChEBI	CHEBI:35936
MDL Number	MFCD00004408
SMILES	OC(=O)CCC=C
Synonym	4-pentenoic acid,allylacetic acid,allyl acetic acid,4 pa,3-vinylpropionic acid,delta 4-pentenoic acid,unii-d4s77y29fb,fema no. 2843,.delta.4-pentenoic acid,wln: qv3u1
IUPAC Name	pent-4-enoic acid
InChI Key	HVAMZGADVCBITI-UHFFFAOYSA-N
Molecular Formula	C5H8O2

2,4-Hexadienoic acid, 99%

CAS: 110-44-1 Molecular Formula: C6H8O2 Molecular Weight (g/mol): 112.13 MDL Number: MFCD00002703 InChI Key: WSWCOQWTEOXDQX-MQQKCMAXSA-N Synonym: sorbic acid,2,4-hexadienoic acid,2e,4e-hexa-2,4-dienoic acid,2e,4e-hexadienoic acid,panosorb,2-propenylacrylic acid,trans,trans-sorbic acid,sorbistat,hexadienoic acid,e,e-2,4-hexadienoic acid PubChem CID: 643460 ChEBI: CHEBI:38358 IUPAC Name: (2E,4E)-hexa-2,4-dienoic acid SMILES: C\C=C\C=C\C(O)=O

Pricing and Availability
Specifications

PubChem CID	643460
CAS	110-44-1
Molecular Weight (g/mol)	112.13
ChEBI	CHEBI:38358
MDL Number	MFCD00002703
SMILES	C\C=C\C=C\C(O)=O
Synonym	sorbic acid,2,4-hexadienoic acid,2e,4e-hexa-2,4-dienoic acid,2e,4e-hexadienoic acid,panosorb,2-propenylacrylic acid,trans,trans-sorbic acid,sorbistat,hexadienoic acid,e,e-2,4-hexadienoic acid
IUPAC Name	(2E,4E)-hexa-2,4-dienoic acid
InChI Key	WSWCOQWTEOXDQX-MQQKCMAXSA-N
Molecular Formula	C6H8O2

Fatty acid conjugates

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