Hexalure

Catalog Number	ACM23192429-2
CAS	23192-42-9
Structure
IUPAC Name	[(Z)-hexadec-7-enyl] acetate
Synonyms	Hexalure;Hexalene;Hexamone;(Z)-7-Hexadecenyl acetate;23192-42-9;cis-7-Hexadecenyl acetate;7-Hexadecen-1-ol, acetate, (Z)-;[(Z)-hexadec-7-enyl] acetate;UNII-2Z6R353O74;7Z-Hexadecenyl acetate;2Z6R353O74;z-7-hexadecenyl acetate;(Z)-Hexadec-7-enyl acetate;(Z)-7-Hexadecen-1-ol acetate;EINECS 245-480-4;ENT 33478;7-Hexadecen-1-ol acetate;BRN 2329612;AI3-33478;SCHEMBL25740;(7Z)-7-Hexadecenyl acetate;Z-7-Hexadecen-1-ol acetate;LMFA07010367;ZINC59725338;7-Hexadecen-1-ol, acetate, (7Z)-;Q27255839
Molecular Weight	282.5g/mol
Molecular Formula	C18H34O2
Canonical SMILES	CCCCCCCCC=CCCCCCCOC(=O)C
InChI	InChI=1S/C18H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-18(2)19/h10-11H,3-9,12-17H2,1-2H3/b11-10-
InChI Key	QVXFGVVYTKZLJN-KHPPLWFESA-N
Complexity	234
Covalently-Bonded Unit Count	1
EC Number	245-480-4
Exact Mass	282.255880323g/mol
Heavy Atom Count	20
Hydrogen Bond Acceptor Count	2
Monoisotopic Mass	282.255880323g/mol
Rotatable Bond Count	15
Topological Polar Surface Area	26.3Å²
UNII	2Z6R353O74
X Log P3	6.9

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