(Z)-11-Hexadecenal

Catalog Number	ACM53939289-1
CAS	53939-28-9
Structure
IUPAC Name	(Z)-hexadec-11-enal
Synonyms	(Z)-11-Hexadecenal;(Z)-Hexadec-11-enal;cis-11-Hexadecenal;53939-28-9;Z-11-hexadecenal;11-HEXADECENAL, (Z)-;11Z-Hexadecenal;UNII-733PD1I6EI;(11Z)-11-Hexadecenal;733PD1I6EI;MFCD00010124;Hercon disrupt;Nomate chokegard;Hercon chek/mate;Heliothis pheromone;Heliothis virescens;Caswell No. 472C;EINECS 258-876-7;(11Z)-hexadec-11-enal;BRN 1867354;AI3-35937;DSSTox_CID_12303;DSSTox_RID_78910;cis-11-Hexadecenyl Aldehyde;DSSTox_GSID_32303;cis-11-Hexadecenal, 95%;SCHEMBL500319;(11Z)-11-Hexadecenal #;Z-11-HEXADECEN-1-AL;CHEMBL3185124;DTXSID1032303;CHEBI:146175;ZINC4521553;Tox21_301824;7715AB;LMFA06000211;AKOS015839807;cis-11-Hexadecenal, analytical standard;NCGC00164107-01;NCGC00255337-01;AS-57027;CAS-53939-28-9;(Z)-11-Hexadecenal 100 microg/mL in Acetonitrile;Q27266129
Molecular Weight	238.41g/mol
Molecular Formula	C16H30O
Canonical SMILES	CCCCC=CCCCCCCCCCC=O
InChI	InChI=1S/C16H30O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h5-6,16H,2-4,7-15H2,1H3/b6-5-
InChI Key	AMTITFMUKRZZEE-WAYWQWQTSA-N
Boiling Point	250.0 °C
Solubility	Chloroform (Slightly), Ethyl Acetate (Slightly)
Appearance	Colourless Oil
Application	Female of the Heliothine species use (Z)-11-Hexadecenal as the major component of their sex pheromones.
Storage	Amber Vial, Refrigerator, Under inert atmosphere
Complexity	172
Covalently-Bonded Unit Count	1
EC Number	258-876-7
Exact Mass	238.229665576g/mol
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	1
Monoisotopic Mass	238.229665576g/mol
References	Choi, M., et al.: J. Chem. Ecol., 42, 425-432 (2016)
Rotatable Bond Count	13
Stability	Air Sensitive, Light Sensitive
Target Pest	Platyptilia carduidactyla (Artichoke Plume Moth),
Topological Polar Surface Area	17.1Å²
UNII	733PD1I6EI
X Log P3	6.1

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