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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346

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Nepsilon-Acetyl-Nalpha-Boc-L-lysine, 98%, Thermo Scientific™

CAS: 6404-26-8 Molecular Formula: C13H24N2O5 Molecular Weight (g/mol): 288.34 MDL Number: MFCD00057791 InChI Key: IOKOUUAPSRCSNT-UEQNJFAPNA-N Synonym: boc-lys ac-oh,n-boc-n'-acetyl-l-lysine,s-6-acetamido-2-tert-butoxycarbonyl amino hexanoic acid,boc-lys-ac-oh,n-boc-n-acetyl-l-lisine,boc-n-epsilon-acetyl-l-lysine,na-t-boc-n-epsilon-acetyl-l-lysine,2s-6-acetylamino-2-tert-butoxycarbonylamino hexanoic acid,2s-2-tert-butoxycarbonyl amino-6-acetamidohexanoic acid PubChem CID: 7016049 IUPAC Name: (2S)-6-acetamido-2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoic acid SMILES: CC(=O)NCCCC[C@H](NC(=O)OC(C)(C)C)C(O)=O

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Specifications

PubChem CID	7016049
CAS	6404-26-8
Molecular Weight (g/mol)	288.34
MDL Number	MFCD00057791
SMILES	CC(=O)NCCCC[C@H](NC(=O)OC(C)(C)C)C(O)=O
Synonym	boc-lys ac-oh,n-boc-n'-acetyl-l-lysine,s-6-acetamido-2-tert-butoxycarbonyl amino hexanoic acid,boc-lys-ac-oh,n-boc-n-acetyl-l-lisine,boc-n-epsilon-acetyl-l-lysine,na-t-boc-n-epsilon-acetyl-l-lysine,2s-6-acetylamino-2-tert-butoxycarbonylamino hexanoic acid,2s-2-tert-butoxycarbonyl amino-6-acetamidohexanoic acid
IUPAC Name	(2S)-6-acetamido-2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoic acid
InChI Key	IOKOUUAPSRCSNT-UEQNJFAPNA-N
Molecular Formula	C13H24N2O5

347

Tetradecanedioic Acid 98.0+%, TCI America™

CAS: 821-38-5 Molecular Formula: C14H26O4 Molecular Weight (g/mol): 258.358 MDL Number: MFCD00002743 InChI Key: HQHCYKULIHKCEB-UHFFFAOYSA-N Synonym: 1,12-dodecanedicarboxylic acid,tetradecane-1,14-dioic acid,1,14-tetradecanedioic acid,unii-uec3ac47h1,dodecamethylenedicarboxylic acid,tetradecanedicarboxylic acid,uec3ac47h1,1,12-dodecanedicarboxylicacid,tetradecanedicarboxylate,pubchem18099 PubChem CID: 13185 ChEBI: CHEBI:76308 IUPAC Name: tetradecanedioic acid SMILES: C(CCCCCCC(=O)O)CCCCCC(=O)O

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PubChem CID	13185
CAS	821-38-5
Molecular Weight (g/mol)	258.358
ChEBI	CHEBI:76308
MDL Number	MFCD00002743
SMILES	C(CCCCCCC(=O)O)CCCCCC(=O)O
Synonym	1,12-dodecanedicarboxylic acid,tetradecane-1,14-dioic acid,1,14-tetradecanedioic acid,unii-uec3ac47h1,dodecamethylenedicarboxylic acid,tetradecanedicarboxylic acid,uec3ac47h1,1,12-dodecanedicarboxylicacid,tetradecanedicarboxylate,pubchem18099
IUPAC Name	tetradecanedioic acid
InChI Key	HQHCYKULIHKCEB-UHFFFAOYSA-N
Molecular Formula	C14H26O4

348

Suberic Acid 99.0+%, TCI America™

CAS: 505-48-6 Molecular Formula: C8H14O4 Molecular Weight (g/mol): 174.20 MDL Number: MFCD00004428 InChI Key: TYFQFVWCELRYAO-UHFFFAOYSA-N Synonym: suberic acid,cork acid,1,6-hexanedicarboxylic acid,1,8-octanedioic acid,hexamethylenedicarboxylic acid,subericacid,1,6-dicarboxyhexane,octane-1,8-dioic acid,octanedioc acid,unii-6u7y4m9c1h PubChem CID: 10457 ChEBI: CHEBI:9300 IUPAC Name: octanedioic acid SMILES: OC(=O)CCCCCCC(O)=O

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PubChem CID	10457
CAS	505-48-6
Molecular Weight (g/mol)	174.20
ChEBI	CHEBI:9300
MDL Number	MFCD00004428
SMILES	OC(=O)CCCCCCC(O)=O
Synonym	suberic acid,cork acid,1,6-hexanedicarboxylic acid,1,8-octanedioic acid,hexamethylenedicarboxylic acid,subericacid,1,6-dicarboxyhexane,octane-1,8-dioic acid,octanedioc acid,unii-6u7y4m9c1h
IUPAC Name	octanedioic acid
InChI Key	TYFQFVWCELRYAO-UHFFFAOYSA-N
Molecular Formula	C8H14O4

349

Hexanoic Acid 98.0+%, TCI America™

CAS: 142-62-1 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00004421 InChI Key: FUZZWVXGSFPDMH-UHFFFAOYSA-N Synonym: caproic acid,capronic acid,n-hexanoic acid,n-caproic acid,butylacetic acid,hexoic acid,pentylformic acid,1-hexanoic acid,n-hexylic acid,n-hexoic acid PubChem CID: 8892 ChEBI: CHEBI:30776 IUPAC Name: hexanoic acid SMILES: CCCCCC(=O)O

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PubChem CID	8892
CAS	142-62-1
Molecular Weight (g/mol)	116.16
ChEBI	CHEBI:30776
MDL Number	MFCD00004421
SMILES	CCCCCC(=O)O
Synonym	caproic acid,capronic acid,n-hexanoic acid,n-caproic acid,butylacetic acid,hexoic acid,pentylformic acid,1-hexanoic acid,n-hexylic acid,n-hexoic acid
IUPAC Name	hexanoic acid
InChI Key	FUZZWVXGSFPDMH-UHFFFAOYSA-N
Molecular Formula	C6H12O2

350

5-Hexynoic Acid 96.0+%, TCI America™

CAS: 53293-00-8 Molecular Formula: C6H8O2 Molecular Weight (g/mol): 112.128 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)	112.128
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

351

Tetrafluorosuccinic Acid 98.0+%, TCI America™

CAS: 377-38-8 Molecular Formula: C4H2F4O4 Molecular Weight (g/mol): 190.05 MDL Number: MFCD00042430 InChI Key: YUDUFRYTKFGQCL-UHFFFAOYSA-N PubChem CID: 67833 IUPAC Name: 2,2,3,3-tetrafluorobutanedioic acid SMILES: C(=O)(C(C(C(=O)O)(F)F)(F)F)O

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Specifications

PubChem CID	67833
CAS	377-38-8
Molecular Weight (g/mol)	190.05
MDL Number	MFCD00042430
SMILES	C(=O)(C(C(C(=O)O)(F)F)(F)F)O
IUPAC Name	2,2,3,3-tetrafluorobutanedioic acid
InChI Key	YUDUFRYTKFGQCL-UHFFFAOYSA-N
Molecular Formula	C4H2F4O4

352

Sorbic Acid 99.0+%, TCI America™

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

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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

353

Potassium Sorbate 99.0+%, TCI America™

CAS: 24634-61-5 Molecular Formula: C6H7KO2 Molecular Weight (g/mol): 150.218 MDL Number: MFCD00016546 InChI Key: CHHHXKFHOYLYRE-STWYSWDKSA-M Synonym: potassium sorbate,sorbistat-k,potassium 2,4-hexadienoate,sorbistat potassium,potassium e,e-sorbate,sorbic acid potassium salt,potassium 2e,4e-hexa-2,4-dienoate,bb powder,sorbistat-potassium,caswell no. 701c PubChem CID: 23676745 ChEBI: CHEBI:77868 IUPAC Name: potassium;(2E,4E)-hexa-2,4-dienoate SMILES: CC=CC=CC(=O)[O-].[K+]

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Specifications

PubChem CID	23676745
CAS	24634-61-5
Molecular Weight (g/mol)	150.218
ChEBI	CHEBI:77868
MDL Number	MFCD00016546
SMILES	CC=CC=CC(=O)[O-].[K+]
Synonym	potassium sorbate,sorbistat-k,potassium 2,4-hexadienoate,sorbistat potassium,potassium e,e-sorbate,sorbic acid potassium salt,potassium 2e,4e-hexa-2,4-dienoate,bb powder,sorbistat-potassium,caswell no. 701c
IUPAC Name	potassium;(2E,4E)-hexa-2,4-dienoate
InChI Key	CHHHXKFHOYLYRE-STWYSWDKSA-M
Molecular Formula	C6H7KO2

354

Potassium Oleate 98.0+%, TCI America™

CAS: 143-18-0 Molecular Formula: C18H33KO2 Molecular Weight (g/mol): 320.558 MDL Number: MFCD00064243 InChI Key: MLICVSDCCDDWMD-UHFFFAOYSA-M Synonym: acmc-209cpw,9-octadecenoic acid 9z-, potassium salt 1:1,ksc175g6j PubChem CID: 44135690 IUPAC Name: potassium;octadec-9-enoate SMILES: CCCCCCCCC=CCCCCCCCC(=O)[O-].[K+]

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Specifications

PubChem CID	44135690
CAS	143-18-0
Molecular Weight (g/mol)	320.558
MDL Number	MFCD00064243
SMILES	CCCCCCCCC=CCCCCCCCC(=O)[O-].[K+]
Synonym	acmc-209cpw,9-octadecenoic acid 9z-, potassium salt 1:1,ksc175g6j
IUPAC Name	potassium;octadec-9-enoate
InChI Key	MLICVSDCCDDWMD-UHFFFAOYSA-M
Molecular Formula	C18H33KO2

355

2-Ethylhexanoic Acid 99.0+%, TCI America™

CAS: 149-57-5 Molecular Formula: C8H16O2 Molecular Weight (g/mol): 144.214 MDL Number: MFCD00002675 InChI Key: OBETXYAYXDNJHR-UHFFFAOYSA-N Synonym: 2-ethylcaproic acid,hexanoic acid, 2-ethyl,ethylhexanoic acid,ethylhexoic acid,2-ethylhexoic acid,butylethylacetic acid,2-butylbutanoic acid,3-heptanecarboxylic acid,ethyl hexanoic acid,2-ethyl-hexoic acid PubChem CID: 8697 IUPAC Name: 2-ethylhexanoic acid SMILES: CCCCC(CC)C(=O)O

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PubChem CID	8697
CAS	149-57-5
Molecular Weight (g/mol)	144.214
MDL Number	MFCD00002675
SMILES	CCCCC(CC)C(=O)O
Synonym	2-ethylcaproic acid,hexanoic acid, 2-ethyl,ethylhexanoic acid,ethylhexoic acid,2-ethylhexoic acid,butylethylacetic acid,2-butylbutanoic acid,3-heptanecarboxylic acid,ethyl hexanoic acid,2-ethyl-hexoic acid
IUPAC Name	2-ethylhexanoic acid
InChI Key	OBETXYAYXDNJHR-UHFFFAOYSA-N
Molecular Formula	C8H16O2

356

9-Decenoic Acid 98.0+%, TCI America™

CAS: 14436-32-9 Molecular Formula: C10H18O2 Molecular Weight (g/mol): 170.252 MDL Number: MFCD00036663 InChI Key: KHAVLLBUVKBTBG-UHFFFAOYSA-N PubChem CID: 61743 ChEBI: CHEBI:32381 IUPAC Name: dec-9-enoic acid SMILES: C=CCCCCCCCC(=O)O

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PubChem CID	61743
CAS	14436-32-9
Molecular Weight (g/mol)	170.252
ChEBI	CHEBI:32381
MDL Number	MFCD00036663
SMILES	C=CCCCCCCCC(=O)O
IUPAC Name	dec-9-enoic acid
InChI Key	KHAVLLBUVKBTBG-UHFFFAOYSA-N
Molecular Formula	C10H18O2

357

6-Bromohexanoic Acid 98.0+%, TCI America™

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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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

358

Sodium Decanoate 99.0+%, TCI America™

CAS: 1002-62-6 Molecular Formula: C10H19NaO2 Molecular Weight (g/mol): 194.25 MDL Number: MFCD00066453 InChI Key: FIWQZURFGYXCEO-UHFFFAOYSA-M Synonym: sodium decanoate,sodium caprate,decanoic acid, sodium salt,decanoic acid sodium salt,sodium caprinate,capric acid sodium salt,sodium-n-decanoate,sodium decanoic acid,capric acid, sodium salt,caprinic acid sodium salt PubChem CID: 4457968 IUPAC Name: sodium decanoate SMILES: [Na+].CCCCCCCCCC([O-])=O

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PubChem CID	4457968
CAS	1002-62-6
Molecular Weight (g/mol)	194.25
MDL Number	MFCD00066453
SMILES	[Na+].CCCCCCCCCC([O-])=O
Synonym	sodium decanoate,sodium caprate,decanoic acid, sodium salt,decanoic acid sodium salt,sodium caprinate,capric acid sodium salt,sodium-n-decanoate,sodium decanoic acid,capric acid, sodium salt,caprinic acid sodium salt
IUPAC Name	sodium decanoate
InChI Key	FIWQZURFGYXCEO-UHFFFAOYSA-M
Molecular Formula	C10H19NaO2

359

Tin(II) 2-Ethylhexanoate 85.0+%, TCI America™

CAS: 301-10-0 Molecular Formula: C16H30O4Sn Molecular Weight (g/mol): 405.122 MDL Number: MFCD00002676 InChI Key: KSBAEPSJVUENNK-UHFFFAOYSA-L Synonym: stannous octoate,tin ii 2-ethylhexanoate,tin octoate,tin ii bis 2-ethylhexanoate,tin 2+ bis 2-ethylhexanoate,tin ethylhexanoate,tin 2-ethylhexanoate,hexanoic acid, 2-ethyl-, tin 2+ salt,stannous 2-ethylhexoate,tin ii 2-ethylhexylate PubChem CID: 9318 IUPAC Name: 2-ethylhexanoate;tin(2+) SMILES: CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Sn+2]

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PubChem CID	9318
CAS	301-10-0
Molecular Weight (g/mol)	405.122
MDL Number	MFCD00002676
SMILES	CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Sn+2]
Synonym	stannous octoate,tin ii 2-ethylhexanoate,tin octoate,tin ii bis 2-ethylhexanoate,tin 2+ bis 2-ethylhexanoate,tin ethylhexanoate,tin 2-ethylhexanoate,hexanoic acid, 2-ethyl-, tin 2+ salt,stannous 2-ethylhexoate,tin ii 2-ethylhexylate
IUPAC Name	2-ethylhexanoate;tin(2+)
InChI Key	KSBAEPSJVUENNK-UHFFFAOYSA-L
Molecular Formula	C16H30O4Sn

360

Oleic Acid 99.0+%, TCI America™

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

Fatty acid conjugates

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