AG00AP0A

1937-63-9 | Cis-11-Octadecenoic Acid Methyl Ester

AG00AP0A

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CAS Number	1937-63-9
Catalog Number	AG00AP0A(AGN-PC-0O6E4T)
Chemical Name	Cis-11-Octadecenoic Acid Methyl Ester
EC Number	217-714-5
IUPAC Name	methyl (Z)-octadec-11-enoate
InChI	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-
InChI Key	PVVODBCDJBGMJL-HJWRWDBZSA-N
MDL Number	MFCD00010457
Molecular Formula	C19H36O2
Molecular Weight	296.4879
SMILES	O=C(OC)CCCCCCCCC/C=CCCCCCC
Synonyms	1937-63-9, cis-11-Octadecenoic acid methyl ester, Methyl cis-11-octadecenoate, Methyl (Z)-octadec-11-enoate, Methyl cis-Vaccenate, cis-Vaccenic acid methyl ester, 11-Octadecenoic acid, methyl ester, (Z)-, Methyl asclepate, AC1NSJPR, Methyl cis-octadec-11-enoate, SCHEMBL546859, PVVODBCDJBGMJL-HJWRWDBZSA-N, Methyl (11Z)-11-octadecenoate #, MFCD00010457, ZINC86020584, cis-11-Octadecenoic acid methyle ster, cis-11-Octadecenoic acid-methyl ester, CC-25841, DB-044832, M2308, Methyl cis-11-octadecenoate, analytical standard, J-012548, Methyl vaccenate, methyl octadec-11-enoate, (Z)-Methyl octadec-11-enoate, C19H36O2, EINECS 217-714-5, C19-H36-O2, CID5364505, 11-Octadecenoic acid, methyl ester, (11Z)-,

Complexity	246
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Exact Mass	296.272g/mol
Formal Charge	0
Heavy Atom Count	21
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	296.495g/mol
Monoisotopic Mass	296.272g/mol
Rotatable Bond Count	16
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	7.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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