6198-58-9

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6198-58-9 Structure

Identification	Back Directory
[Name] TRANS-11-OCTADECENOIC ACID METHYL ESTER
[CAS] 6198-58-9
[Synonyms] Einecs 228-251-3 METHYL VACCENATE METHYL TRANS-VACCENATE TRANS-METHYL VACCENATE METHYL VACCENATE (TRANS) Methyl Vaccenate Standard METHYL-TRANS-VACCENATE(RG) methyl (E)-11-octadecenoate methyl (E)-octadec-11-enoate METHYL-11-TRANSOCTADECENOATE Methyl Transvaccenate(C18:1T) METHYL TRANS-11-OCTADECENOATE (E)-Vaccenic acid methyl ester Methyltrans-11-Octadecenoate> TRANS-VACCENIC ACID METHYL ESTER trans-11-Octadecenoic methyl este trans-11-octadecenoic methyl ester Methyl trans-11-Octadecenoate (E)-11-Octadecenoic acid methyl ester (11E)-11-Octadecenoic acid methyl ester TRANS-11-OCTADECENOIC ACID METHYL ESTER 11-Octadecenoic acid, methyl ester, (11E)- DELTA 11 TRANS OCTADECENOIC ACID METHYL ESTER Methyl?trans-11-octadecenoate Solution, 100μg/mL trans-11-Octadecenoic acid methyl ester, Methyl trans-11-octadecenoate Methyl trans-vaccenate,trans-11-Octadecenoic acid methyl ester, Methyl trans-11-octadecenoate
[EINECS(EC#)] 228-251-3
[Molecular Formula] C19H36O2
[MDL Number] MFCD00064484
[MOL File] 6198-58-9.mol
[Molecular Weight] 296.49

Chemical Properties	Back Directory
[Melting point ] 10°C(lit.)
[Boiling point ] 154°C/1mmHg(lit.)
[density ] 0.873±0.06 g/cm3(Predicted)
[refractive index ] 1.4500 to 1.4540
[Fp ] -4 °C
[storage temp. ] −20°C
[solubility ] DMF: 30 mg/ml; DMSO: 30 mg/ml; Ethanol: 50 mg/ml
[form ] liquid
[color ] Colorless to Light yellow
[biological source] synthetic (organic)
[InChI] 1S/C19H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h8-9H,3-7,10-18H2,1-2H3/b9-8+
[InChIKey] PVVODBCDJBGMJL-CMDGGOBGSA-N
[SMILES] [H]\C(CCCCCC)=C(\[H])CCCCCCCCCC(=O)OC
[LogP] 8.160 (est)

Safety Data	Back Directory
[Hazard Codes ] Xi,N,Xn,F
[Risk Statements ] 36/37/38-67-65-50/53-38-11
[Safety Statements ] 26-36-62-61-60-33-29-16-9
[RIDADR ] UN 1206 3/PG 2
[WGK Germany ] 1
[HS Code ] 2916.19.5000
[Storage Class] 10 - Combustible liquids
[Hazard Classifications] Eye Irrit. 2 Skin Irrit. 2 STOT SE 3

Hazard Information	Back Directory
[Uses] Vaccenic Acid methyl Ester is the methyl ester of Vaccenic Acid (V070000) which is a fatty acid found in Artemia salina that shows antimicrobial activity against a variety of microorganisms except Escherichia coli, Micrococcus luteus and Salmonella enteritidis.

Spectrum Detail	Back Directory
[Spectrum Detail] TRANS-11-OCTADECENOIC ACID METHYL ESTER(6198-58-9)¹HNMR

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