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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10-Undecenoic acid, 99%

CAS: 112-38-9 Molecular Formula: C11H20O2 Molecular Weight (g/mol): 184.279 MDL Number: MFCD00004442 InChI Key: FRPZMMHWLSIFAZ-UHFFFAOYSA-N Synonym: 10-undecenoic acid,undecylenic acid,desenex,10-hendecenoic acid,renselin,declid,sevinon,10-undecylenic acid,9-undecylenic acid,undecyl-10-enic acid PubChem CID: 5634 ChEBI: CHEBI:35045 IUPAC Name: undec-10-enoic acid SMILES: C=CCCCCCCCCC(=O)O

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PubChem CID	5634
CAS	112-38-9
Molecular Weight (g/mol)	184.279
ChEBI	CHEBI:35045
MDL Number	MFCD00004442
SMILES	C=CCCCCCCCCC(=O)O
Synonym	10-undecenoic acid,undecylenic acid,desenex,10-hendecenoic acid,renselin,declid,sevinon,10-undecylenic acid,9-undecylenic acid,undecyl-10-enic acid
IUPAC Name	undec-10-enoic acid
InChI Key	FRPZMMHWLSIFAZ-UHFFFAOYSA-N
Molecular Formula	C11H20O2

Thermo Scientific Chemicals Eicosanoic acid, 98%

CAS: 506-30-9 Molecular Formula: C20H40O2 Molecular Weight (g/mol): 312.54 MDL Number: MFCD00002755 InChI Key: VKOBVWXKNCXXDE-UHFFFAOYSA-N Synonym: arachidic acid,eicosanoic acid,arachic acid,n-eicosanoic acid,arachidinic acid,arachidate,eicosanoate,unii-pqb8mjd4rb,pqb8mjd4rb,n-eicosanoate PubChem CID: 10467 ChEBI: CHEBI:28822 IUPAC Name: icosanoic acid SMILES: CCCCCCCCCCCCCCCCCCCC(O)=O

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PubChem CID	10467
CAS	506-30-9
Molecular Weight (g/mol)	312.54
ChEBI	CHEBI:28822
MDL Number	MFCD00002755
SMILES	CCCCCCCCCCCCCCCCCCCC(O)=O
Synonym	arachidic acid,eicosanoic acid,arachic acid,n-eicosanoic acid,arachidinic acid,arachidate,eicosanoate,unii-pqb8mjd4rb,pqb8mjd4rb,n-eicosanoate
IUPAC Name	icosanoic acid
InChI Key	VKOBVWXKNCXXDE-UHFFFAOYSA-N
Molecular Formula	C20H40O2

2-Hexynoic acid, 96%

CAS: 764-33-0 Molecular Formula: C6H8O2 Molecular Weight (g/mol): 112.128 MDL Number: MFCD00014371 InChI Key: AKYAUBWOTZJUBI-UHFFFAOYSA-N Synonym: 2-hexynoic acid,hexynoic acid,acmc-1bezk,akyaubwotzjubi-uhfffaoysa PubChem CID: 324380 IUPAC Name: hex-2-ynoic acid SMILES: CCCC#CC(=O)O

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PubChem CID	324380
CAS	764-33-0
Molecular Weight (g/mol)	112.128
MDL Number	MFCD00014371
SMILES	CCCC#CC(=O)O
Synonym	2-hexynoic acid,hexynoic acid,acmc-1bezk,akyaubwotzjubi-uhfffaoysa
IUPAC Name	hex-2-ynoic acid
InChI Key	AKYAUBWOTZJUBI-UHFFFAOYSA-N
Molecular Formula	C6H8O2

2-Octynoic acid, 98%

CAS: 5663-96-7 Molecular Formula: C8H12O2 Molecular Weight (g/mol): 140.182 MDL Number: MFCD00004364 InChI Key: BQDKCWCMDBMLEH-UHFFFAOYSA-N Synonym: 2-octynoic acid,2-octyn-1-oic acid,m-pentyl propiolate,propiolic acid, pentyl,propiolic acid, pentyl ester,pentylpropiolic acid,2-oa,2-octynoicacid,acmc-1apg2,epitope id:137475 PubChem CID: 21872 ChEBI: CHEBI:60295 IUPAC Name: oct-2-ynoic acid SMILES: CCCCCC#CC(=O)O

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PubChem CID	21872
CAS	5663-96-7
Molecular Weight (g/mol)	140.182
ChEBI	CHEBI:60295
MDL Number	MFCD00004364
SMILES	CCCCCC#CC(=O)O
Synonym	2-octynoic acid,2-octyn-1-oic acid,m-pentyl propiolate,propiolic acid, pentyl,propiolic acid, pentyl ester,pentylpropiolic acid,2-oa,2-octynoicacid,acmc-1apg2,epitope id:137475
IUPAC Name	oct-2-ynoic acid
InChI Key	BQDKCWCMDBMLEH-UHFFFAOYSA-N
Molecular Formula	C8H12O2

Thermo Scientific Chemicals Undecylenic acid, 98+%

CAS: 112-38-9 Molecular Formula: C₁₁H₂₀O₂ Molecular Weight (g/mol): 184.28 MDL Number: MFCD00004442 InChI Key: FRPZMMHWLSIFAZ-UHFFFAOYSA-N Synonym: 10-undecenoic acid,undecylenic acid,desenex,10-hendecenoic acid,renselin,declid,sevinon,10-undecylenic acid,9-undecylenic acid,undecyl-10-enic acid PubChem CID: 5634 ChEBI: CHEBI:35045 IUPAC Name: undec-10-enoic acid SMILES: C=CCCCCCCCCC(=O)O

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Specifications

PubChem CID	5634
CAS	112-38-9
Molecular Weight (g/mol)	184.28
ChEBI	CHEBI:35045
MDL Number	MFCD00004442
SMILES	C=CCCCCCCCCC(=O)O
Synonym	10-undecenoic acid,undecylenic acid,desenex,10-hendecenoic acid,renselin,declid,sevinon,10-undecylenic acid,9-undecylenic acid,undecyl-10-enic acid
IUPAC Name	undec-10-enoic acid
InChI Key	FRPZMMHWLSIFAZ-UHFFFAOYSA-N
Molecular Formula	C₁₁H₂₀O₂

Oleic acid, 99%

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 IUPAC Name: (Z)-octadec-9-enoic acid SMILES: CCCCCCCC\C=C\CCCCCCCC(O)=O

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Specifications

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
IUPAC Name	(Z)-octadec-9-enoic acid
InChI Key	ZQPPMHVWECSIRJ-MDZDMXLPSA-N
Molecular Formula	C18H34O2

Nonanoic acid, 97%

CAS: 112-05-0 Molecular Formula: C9H18O2 Molecular Weight (g/mol): 158.241 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

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PubChem CID	8158
CAS	112-05-0
Molecular Weight (g/mol)	158.241
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

(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

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

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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

10-Undecynoic acid, 96%

CAS: 2777-65-3 Molecular Formula: C11H18O2 Molecular Weight (g/mol): 182.263 MDL Number: MFCD00014389 InChI Key: OAOUTNMJEFWJPO-UHFFFAOYSA-N Synonym: 10-undecynoic acid,hendecynoic acid,unii-2f79g7h1wy,undec-10-ynoicacid,acmc-1cp9s,undec-1-yn-11-oic acid,4-02-00-01738 beilstein handbook reference PubChem CID: 31039 IUPAC Name: undec-10-ynoic acid SMILES: C#CCCCCCCCCC(=O)O

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PubChem CID	31039
CAS	2777-65-3
Molecular Weight (g/mol)	182.263
MDL Number	MFCD00014389
SMILES	C#CCCCCCCCCC(=O)O
Synonym	10-undecynoic acid,hendecynoic acid,unii-2f79g7h1wy,undec-10-ynoicacid,acmc-1cp9s,undec-1-yn-11-oic acid,4-02-00-01738 beilstein handbook reference
IUPAC Name	undec-10-ynoic acid
InChI Key	OAOUTNMJEFWJPO-UHFFFAOYSA-N
Molecular Formula	C11H18O2

5-Hexynoic acid, 97%

CAS: 53293-00-8 Molecular Formula: C₆H₈O₂ Molecular Weight (g/mol): 112.13 MDL Number: MFCD00066346 InChI Key: VPFMEXRVUOPYRG-UHFFFAOYSA-N Synonym: 5-hexynoic acid,5-hexyn-1-oic acid,4-ethynylbutyric acid,acmc-1an4h PubChem CID: 143036 ChEBI: CHEBI:73511 IUPAC Name: hex-5-ynoic acid SMILES: C#CCCCC(=O)O

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Specifications

PubChem CID	143036
CAS	53293-00-8
Molecular Weight (g/mol)	112.13
ChEBI	CHEBI:73511
MDL Number	MFCD00066346
SMILES	C#CCCCC(=O)O
Synonym	5-hexynoic acid,5-hexyn-1-oic acid,4-ethynylbutyric acid,acmc-1an4h
IUPAC Name	hex-5-ynoic acid
InChI Key	VPFMEXRVUOPYRG-UHFFFAOYSA-N
Molecular Formula	C₆H₈O₂

7-Phenylheptanoic acid, 97%

CAS: 40228-90-8 Molecular Formula: C13H18O2 Molecular Weight (g/mol): 206.285 MDL Number: MFCD00037801 InChI Key: ZVSXKFNTWOIGJI-UHFFFAOYSA-N Synonym: benzeneheptanoic acid,phenylheptanoic acid,7-phenyl-heptanoic acid,acmc-20alwn,7-phenylheptanoic acid,xxc PubChem CID: 520987 IUPAC Name: 7-phenylheptanoic acid SMILES: C1=CC=C(C=C1)CCCCCCC(=O)O

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Specifications

PubChem CID	520987
CAS	40228-90-8
Molecular Weight (g/mol)	206.285
MDL Number	MFCD00037801
SMILES	C1=CC=C(C=C1)CCCCCCC(=O)O
Synonym	benzeneheptanoic acid,phenylheptanoic acid,7-phenyl-heptanoic acid,acmc-20alwn,7-phenylheptanoic acid,xxc
IUPAC Name	7-phenylheptanoic acid
InChI Key	ZVSXKFNTWOIGJI-UHFFFAOYSA-N
Molecular Formula	C13H18O2

Zinc stearate

CAS: 557-05-1 MDL Number: MFCD00013031 InChI Key: XOOUIPVCVHRTMJ-UHFFFAOYSA-L Synonym: zinc stearate,zinc distearate,zinc octadecanoate,stearates,hydense,metallac,hytech,mathe,coad,zink distearat PubChem CID: 11178 IUPAC Name: zinc;octadecanoate SMILES: CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].[Zn+2]

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Specifications

PubChem CID	11178
CAS	557-05-1
MDL Number	MFCD00013031
SMILES	CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].[Zn+2]
Synonym	zinc stearate,zinc distearate,zinc octadecanoate,stearates,hydense,metallac,hytech,mathe,coad,zink distearat
IUPAC Name	zinc;octadecanoate
InChI Key	XOOUIPVCVHRTMJ-UHFFFAOYSA-L

Zinc 2-ethylhexanoate, ca 80% in mineral spirits (17-19% Zn)

CAS: 136-53-8 Molecular Formula: C16H30O4Zn Molecular Weight (g/mol): 351.792 MDL Number: MFCD00053316 InChI Key: IFNXAMCERSVZCV-UHFFFAOYSA-L Synonym: zinc 2-ethylhexanoate,zinc bis 2-ethylhexanoate,zinc 2-ethylhexoate,hexanoic acid, 2-ethyl-, zinc salt,hexanoic acid, 2-ethyl-, zinc salt 2:1,zinc ethylhexanoate,hexanoic acid, 2-ethyl-, zinc salt, basic,zinc 2-ethylhexanoate 100g,zinc 2+ ion bis 2-ethylhexanoate PubChem CID: 61083 IUPAC Name: zinc;2-ethylhexanoate SMILES: CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Zn+2]

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PubChem CID	61083
CAS	136-53-8
Molecular Weight (g/mol)	351.792
MDL Number	MFCD00053316
SMILES	CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Zn+2]
Synonym	zinc 2-ethylhexanoate,zinc bis 2-ethylhexanoate,zinc 2-ethylhexoate,hexanoic acid, 2-ethyl-, zinc salt,hexanoic acid, 2-ethyl-, zinc salt 2:1,zinc ethylhexanoate,hexanoic acid, 2-ethyl-, zinc salt, basic,zinc 2-ethylhexanoate 100g,zinc 2+ ion bis 2-ethylhexanoate
IUPAC Name	zinc;2-ethylhexanoate
InChI Key	IFNXAMCERSVZCV-UHFFFAOYSA-L
Molecular Formula	C16H30O4Zn

4-Cyanobutyric acid, 95%

CAS: 39201-33-7 Molecular Formula: C5H7NO2 Molecular Weight (g/mol): 113.116 MDL Number: MFCD00218781 InChI Key: YXBVMSQDRLXPQV-UHFFFAOYSA-N Synonym: 4-cyanobutyric acid,butanoic acid, 4-cyano,4-cyanobutanoicacid PubChem CID: 38239 IUPAC Name: 4-cyanobutanoic acid SMILES: C(CC#N)CC(=O)O

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Specifications

PubChem CID	38239
CAS	39201-33-7
Molecular Weight (g/mol)	113.116
MDL Number	MFCD00218781
SMILES	C(CC#N)CC(=O)O
Synonym	4-cyanobutyric acid,butanoic acid, 4-cyano,4-cyanobutanoicacid
IUPAC Name	4-cyanobutanoic acid
InChI Key	YXBVMSQDRLXPQV-UHFFFAOYSA-N
Molecular Formula	C5H7NO2

Fatty acid conjugates

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