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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241 – 255 of 2,379 results

241

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2-Bromohexanoic acid, 97%

CAS: 616-05-7 Molecular Formula: C6H11BrO2 Molecular Weight (g/mol): 195.056 MDL Number: MFCD00004218 InChI Key: HZTPKMIMXLTOSK-UHFFFAOYSA-N Synonym: 2-bromocaproic acid,dl-2-bromohexanoic acid,hexanoic acid, 2-bromo,alpha-bromohexanoic acid,alpha-bromo-n-caproic acid,.alpha.-bromo-n-caproic acid,2-bromo-hexanoic acid,.alpha.-bromocaproic acid,.alpha.-bromohexanoic acid,2-bromo-n-hexanoic acid PubChem CID: 12013 IUPAC Name: 2-bromohexanoic acid SMILES: CCCCC(C(=O)O)Br

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Specifications

PubChem CID	12013
CAS	616-05-7
Molecular Weight (g/mol)	195.056
MDL Number	MFCD00004218
SMILES	CCCCC(C(=O)O)Br
Synonym	2-bromocaproic acid,dl-2-bromohexanoic acid,hexanoic acid, 2-bromo,alpha-bromohexanoic acid,alpha-bromo-n-caproic acid,.alpha.-bromo-n-caproic acid,2-bromo-hexanoic acid,.alpha.-bromocaproic acid,.alpha.-bromohexanoic acid,2-bromo-n-hexanoic acid
IUPAC Name	2-bromohexanoic acid
InChI Key	HZTPKMIMXLTOSK-UHFFFAOYSA-N
Molecular Formula	C6H11BrO2

242

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2-Hydroxy-3-methylbutyric acid, 97%

CAS: 4026-18-0 Molecular Formula: C5H10O3 Molecular Weight (g/mol): 118.132 MDL Number: MFCD00004242 InChI Key: NGEWQZIDQIYUNV-UHFFFAOYSA-N Synonym: 2-hydroxy-3-methylbutyric acid,2-hydroxyisovaleric acid,alpha-hydroxyisovaleric acid,2-oxyisovaleric acid,3-methyl-2-hydroxybutyric acid,butanoic acid, 2-hydroxy-3-methyl,2-hydroxyisopentanoic acid,dl-2-hydroxyisovaleric acid,dl-2-hydroxy-3-methylbutanoic acid,2-hydroxyisopentanoate PubChem CID: 99823 ChEBI: CHEBI:60645 IUPAC Name: 2-hydroxy-3-methylbutanoic acid SMILES: CC(C)C(C(=O)O)O

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Specifications

PubChem CID	99823
CAS	4026-18-0
Molecular Weight (g/mol)	118.132
ChEBI	CHEBI:60645
MDL Number	MFCD00004242
SMILES	CC(C)C(C(=O)O)O
Synonym	2-hydroxy-3-methylbutyric acid,2-hydroxyisovaleric acid,alpha-hydroxyisovaleric acid,2-oxyisovaleric acid,3-methyl-2-hydroxybutyric acid,butanoic acid, 2-hydroxy-3-methyl,2-hydroxyisopentanoic acid,dl-2-hydroxyisovaleric acid,dl-2-hydroxy-3-methylbutanoic acid,2-hydroxyisopentanoate
IUPAC Name	2-hydroxy-3-methylbutanoic acid
InChI Key	NGEWQZIDQIYUNV-UHFFFAOYSA-N
Molecular Formula	C5H10O3

243

5-Hydroxydecanoic acid sodium salt, 98%

CAS: 624-00-0 Molecular Formula: C10H20O3 Molecular Weight (g/mol): 188.267 MDL Number: MFCD00153808 InChI Key: LMHJFKYQYDSOQO-UHFFFAOYSA-N Synonym: 5-hydroxydecanoate,5-hydroxy capric acid,5-hydroxy-decanoic acid,decanoic acid, 5-hydroxy,sodium salt,decanoic acid, 5-hydroxy-, 5s,acmc-20mvfk,xi-5-hydroxydecanoic acid PubChem CID: 1825 IUPAC Name: 5-hydroxydecanoic acid SMILES: CCCCCC(CCCC(=O)O)O

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Specifications

PubChem CID	1825
CAS	624-00-0
Molecular Weight (g/mol)	188.267
MDL Number	MFCD00153808
SMILES	CCCCCC(CCCC(=O)O)O
Synonym	5-hydroxydecanoate,5-hydroxy capric acid,5-hydroxy-decanoic acid,decanoic acid, 5-hydroxy,sodium salt,decanoic acid, 5-hydroxy-, 5s,acmc-20mvfk,xi-5-hydroxydecanoic acid
IUPAC Name	5-hydroxydecanoic acid
InChI Key	LMHJFKYQYDSOQO-UHFFFAOYSA-N
Molecular Formula	C10H20O3

244

Palmitic acid, 95%

CAS: 57-10-3 Molecular Formula: C16H32O2 Molecular Weight (g/mol): 256.43 MDL Number: MFCD00002747 InChI Key: IPCSVZSSVZVIGE-UHFFFAOYSA-N Synonym: palmitic acid,cetylic acid,palmitate,n-hexadecanoic acid,hexadecylic acid,hydrofol,n-hexadecoic acid,1-pentadecanecarboxylic acid,palmitinic acid,pentadecanecarboxylic acid PubChem CID: 985 ChEBI: CHEBI:15756 IUPAC Name: hexadecanoic acid SMILES: CCCCCCCCCCCCCCCC(O)=O

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Specifications

PubChem CID	985
CAS	57-10-3
Molecular Weight (g/mol)	256.43
ChEBI	CHEBI:15756
MDL Number	MFCD00002747
SMILES	CCCCCCCCCCCCCCCC(O)=O
Synonym	palmitic acid,cetylic acid,palmitate,n-hexadecanoic acid,hexadecylic acid,hydrofol,n-hexadecoic acid,1-pentadecanecarboxylic acid,palmitinic acid,pentadecanecarboxylic acid
IUPAC Name	hexadecanoic acid
InChI Key	IPCSVZSSVZVIGE-UHFFFAOYSA-N
Molecular Formula	C16H32O2

245

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trans-3-Hexenoic acid, 97%

CAS: 1577-18-0 Molecular Formula: C6H10O2 Molecular Weight (g/mol): 114.14 MDL Number: MFCD00002786 InChI Key: XXHDAWYDNSXJQM-ONEGZZNKSA-N Synonym: trans-3-hexenoic acid,hydrosorbic acid,3-hexenoic acid,e-hex-3-enoic acid,3-hexenoic acid, 3e,e-3-hexenoic acid,3-hexenoic acid, e,trans-hex-3-enoic acid,unii-9b3n069edg,fema no. 3170 PubChem CID: 5282708 ChEBI: CHEBI:49285 IUPAC Name: (E)-hex-3-enoic acid SMILES: CC\C=C\CC(O)=O

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Specifications

PubChem CID	5282708
CAS	1577-18-0
Molecular Weight (g/mol)	114.14
ChEBI	CHEBI:49285
MDL Number	MFCD00002786
SMILES	CC\C=C\CC(O)=O
Synonym	trans-3-hexenoic acid,hydrosorbic acid,3-hexenoic acid,e-hex-3-enoic acid,3-hexenoic acid, 3e,e-3-hexenoic acid,3-hexenoic acid, e,trans-hex-3-enoic acid,unii-9b3n069edg,fema no. 3170
IUPAC Name	(E)-hex-3-enoic acid
InChI Key	XXHDAWYDNSXJQM-ONEGZZNKSA-N
Molecular Formula	C6H10O2

246

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Suberic acid, 99%

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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Specifications

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

247

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Dodecanedioic acid, 99%

CAS: 693-23-2 Molecular Formula: C12H22O4 Molecular Weight (g/mol): 230.304 MDL Number: MFCD00002735 InChI Key: TVIDDXQYHWJXFK-UHFFFAOYSA-N Synonym: 1,12-dodecanedioic acid,1,10-decanedicarboxylic acid,decamethylenedicarboxylic acid,1,10-dicarboxydecane,n-dodecanedioic acid,unii-978yu42q6i,dsstox_cid_7297,dsstox_rid_78394,dsstox_gsid_27297,n-dodecanedioate PubChem CID: 12736 ChEBI: CHEBI:4676 IUPAC Name: dodecanedioic acid SMILES: C(CCCCCC(=O)O)CCCCC(=O)O

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Specifications

PubChem CID	12736
CAS	693-23-2
Molecular Weight (g/mol)	230.304
ChEBI	CHEBI:4676
MDL Number	MFCD00002735
SMILES	C(CCCCCC(=O)O)CCCCC(=O)O
Synonym	1,12-dodecanedioic acid,1,10-decanedicarboxylic acid,decamethylenedicarboxylic acid,1,10-dicarboxydecane,n-dodecanedioic acid,unii-978yu42q6i,dsstox_cid_7297,dsstox_rid_78394,dsstox_gsid_27297,n-dodecanedioate
IUPAC Name	dodecanedioic acid
InChI Key	TVIDDXQYHWJXFK-UHFFFAOYSA-N
Molecular Formula	C12H22O4

248

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2-Bromoisovaleric acid, 96%

CAS: 565-74-2 Molecular Formula: C5H9BrO2 Molecular Weight (g/mol): 181.029 MDL Number: MFCD00004210 InChI Key: UEBARDWJXBGYEJ-UHFFFAOYSA-N Synonym: 2-bromo-3-methylbutyric acid,2-bromoisovaleric acid,butanoic acid, 2-bromo-3-methyl,alpha-bromoisovaleric acid,butyric acid, 2-bromo-3-methyl,2-bromo-3-methyl-butanoic acid,.alpha.-bromoisovaleric acid,+/--2-bromo-3-methylbutyric acid,bromisovaleriansaure,acmc-209wpb PubChem CID: 11268 IUPAC Name: 2-bromo-3-methylbutanoic acid SMILES: CC(C)C(C(=O)O)Br

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Specifications

PubChem CID	11268
CAS	565-74-2
Molecular Weight (g/mol)	181.029
MDL Number	MFCD00004210
SMILES	CC(C)C(C(=O)O)Br
Synonym	2-bromo-3-methylbutyric acid,2-bromoisovaleric acid,butanoic acid, 2-bromo-3-methyl,alpha-bromoisovaleric acid,butyric acid, 2-bromo-3-methyl,2-bromo-3-methyl-butanoic acid,.alpha.-bromoisovaleric acid,+/--2-bromo-3-methylbutyric acid,bromisovaleriansaure,acmc-209wpb
IUPAC Name	2-bromo-3-methylbutanoic acid
InChI Key	UEBARDWJXBGYEJ-UHFFFAOYSA-N
Molecular Formula	C5H9BrO2

249

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meso-2,3-Dibromosuccinic acid, 98%, Thermo Scientific Chemicals

CAS: 608-36-6 Molecular Formula: C4H2Br2O4 Molecular Weight (g/mol): 273.87 MDL Number: MFCD00066439 InChI Key: FJWGRXKOBIVTFA-XIXRPRMCSA-L Synonym: 2r,3s-2,3-dibromosuccinic acid,meso-2,3-dibromosuccinic acid,unii-d2ii9ugq9x,d2ii9ugq9x,butanedioic acid, 2,3-dibromo-, 2r,3s-rel,2r,3s-rel-2,3-dibromosuccinic acid,2r,3s-2,3-dibromobutanedioic acid,meso-dibromosuccinic acid,2,3-dibromosuccinic acid, meso,2,3-dibromosuccinic acid meso-form mi PubChem CID: 641611 IUPAC Name: (2S,3R)-2,3-dibromobutanedioic acid SMILES: [O-]C(=O)[C@@H](Br)[C@@H](Br)C([O-])=O

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Specifications

PubChem CID	641611
CAS	608-36-6
Molecular Weight (g/mol)	273.87
MDL Number	MFCD00066439
SMILES	[O-]C(=O)[C@@H](Br)[C@@H](Br)C([O-])=O
Synonym	2r,3s-2,3-dibromosuccinic acid,meso-2,3-dibromosuccinic acid,unii-d2ii9ugq9x,d2ii9ugq9x,butanedioic acid, 2,3-dibromo-, 2r,3s-rel,2r,3s-rel-2,3-dibromosuccinic acid,2r,3s-2,3-dibromobutanedioic acid,meso-dibromosuccinic acid,2,3-dibromosuccinic acid, meso,2,3-dibromosuccinic acid meso-form mi
IUPAC Name	(2S,3R)-2,3-dibromobutanedioic acid
InChI Key	FJWGRXKOBIVTFA-XIXRPRMCSA-L
Molecular Formula	C4H2Br2O4

250

(S)-2-[(tert-Butoxycarbonyl)amino]-5-(dimethylamino)pentanoic acid, Thermo Scientific™

CAS: 65671-54-7 Molecular Formula: C12H24N2O4 Molecular Weight (g/mol): 260.334 InChI Key: HBCLYVIARHJTTL-VIFPVBQESA-N Synonym: s-2-tert-butoxycarbonyl amino-5-dimethylamino pentanoic acid,2s-2-tert-butoxycarbonyl amino-5-dimethylamino pentanoic acid,s-2-boc-amino-5-dimethylamino pentanoic acid,s-2-tert-butoxycarbonyl amino-5-dimethylami,n∼2∼-tert-butoxycarbonyl-n∼5∼,n∼5∼-dimethyl-l-ornithine,s-2-tert-butoxycarbonylamino-5-dimethylamino pentanoic acid,l-ornithine, n2-1,1-dimethylethoxy carbonyl-n5,n5-dimethyl,2s-5-dimethylamino-2-tert-butoxy carbonylamino pentanoic acid PubChem CID: 16105709 IUPAC Name: (2S)-5-(dimethylamino)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoic acid SMILES: CC(C)(C)OC(=O)NC(CCCN(C)C)C(=O)O

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Specifications

PubChem CID	16105709
CAS	65671-54-7
Molecular Weight (g/mol)	260.334
SMILES	CC(C)(C)OC(=O)NC(CCCN(C)C)C(=O)O
Synonym	s-2-tert-butoxycarbonyl amino-5-dimethylamino pentanoic acid,2s-2-tert-butoxycarbonyl amino-5-dimethylamino pentanoic acid,s-2-boc-amino-5-dimethylamino pentanoic acid,s-2-tert-butoxycarbonyl amino-5-dimethylami,n∼2∼-tert-butoxycarbonyl-n∼5∼,n∼5∼-dimethyl-l-ornithine,s-2-tert-butoxycarbonylamino-5-dimethylamino pentanoic acid,l-ornithine, n2-1,1-dimethylethoxy carbonyl-n5,n5-dimethyl,2s-5-dimethylamino-2-tert-butoxy carbonylamino pentanoic acid
IUPAC Name	(2S)-5-(dimethylamino)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoic acid
InChI Key	HBCLYVIARHJTTL-VIFPVBQESA-N
Molecular Formula	C12H24N2O4

251

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Ethyl 3-cyclopropyl-3-oxopropionate, 96%

CAS: 24922-02-9 Molecular Formula: C8H12O3 Molecular Weight (g/mol): 156.18 MDL Number: MFCD00184570 InChI Key: LFSVADABIDBSBV-UHFFFAOYSA-N Synonym: 3-cyclopropyl-3-oxo-propionic acid ethyl ester,ethyl 3-cyclopropyl-3-oxo-propanoate,ethyl 3-cyclopropyl-3-oxopropionate,ethyl 3-cyclopropyl-3-oxo-propionate,ethyl beta-oxo-cyclopropane propionate,ksc205o7f,ethyl cyclopropylcarbonylacetate,carbethoxymethyl cyclopropyl ketone,ethyl ?-oxo-cyclopropanepropionate,ethyl3-cyclopropyl-3-oxopropanoate PubChem CID: 262979 IUPAC Name: ethyl 3-cyclopropyl-3-oxopropanoate SMILES: CCOC(=O)CC(=O)C1CC1

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Specifications

PubChem CID	262979
CAS	24922-02-9
Molecular Weight (g/mol)	156.18
MDL Number	MFCD00184570
SMILES	CCOC(=O)CC(=O)C1CC1
Synonym	3-cyclopropyl-3-oxo-propionic acid ethyl ester,ethyl 3-cyclopropyl-3-oxo-propanoate,ethyl 3-cyclopropyl-3-oxopropionate,ethyl 3-cyclopropyl-3-oxo-propionate,ethyl beta-oxo-cyclopropane propionate,ksc205o7f,ethyl cyclopropylcarbonylacetate,carbethoxymethyl cyclopropyl ketone,ethyl ?-oxo-cyclopropanepropionate,ethyl3-cyclopropyl-3-oxopropanoate
IUPAC Name	ethyl 3-cyclopropyl-3-oxopropanoate
InChI Key	LFSVADABIDBSBV-UHFFFAOYSA-N
Molecular Formula	C8H12O3

252

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Hexacosanoic acid, 98%

CAS: 506-46-7 Molecular Formula: C₂₆H₅₂O₂ Molecular Weight (g/mol): 396.7 MDL Number: MFCD00002811 InChI Key: XMHIUKTWLZUKEX-UHFFFAOYSA-N Synonym: cerotic acid,ceric acid,ceratinic acid,cerinic acid,hexacosanic acid,cerylic acid,cerotinic acid,n-hexacosanoic acid,unii-d42cqn6p36,cerate PubChem CID: 10469 ChEBI: CHEBI:31009 IUPAC Name: hexacosanoic acid SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O

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Specifications

PubChem CID	10469
CAS	506-46-7
Molecular Weight (g/mol)	396.7
ChEBI	CHEBI:31009
MDL Number	MFCD00002811
SMILES	CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O
Synonym	cerotic acid,ceric acid,ceratinic acid,cerinic acid,hexacosanic acid,cerylic acid,cerotinic acid,n-hexacosanoic acid,unii-d42cqn6p36,cerate
IUPAC Name	hexacosanoic acid
InChI Key	XMHIUKTWLZUKEX-UHFFFAOYSA-N
Molecular Formula	C₂₆H₅₂O₂

253

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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

254

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

255

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Elaidic Acid, 98%

CAS: 112-79-8 Molecular Formula: C₁₈H₃₄O₂ Molecular Weight (g/mol): 282.46 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)	282.46
ChEBI	CHEBI:27997
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

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