2-Octadecenal

Catalog Number	ACM51534373-5
CAS	51534-37-3
Structure
IUPAC Name	(E)-octadec-2-enal
Synonyms	2-OCTADECENAL;(E)-octadec-2-enal;2E-Octadecenal;56554-96-2;51534-37-3;(E)-2-OCTADECENAL;Koiganal I;2-Trans-octadecenal;SCHEMBL1302152;SCHEMBL1302154;CHEBI:165518;LMFA06000232;ZINC59725594;AKOS015959074
Molecular Weight	266.5g/mol
Molecular Formula	C18H34O
Canonical SMILES	CCCCCCCCCCCCCCCC=CC=O
InChI	InChI=1S/C18H34O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h16-18H,2-15H2,1H3/b17-16+
InChI Key	AHQSSWHOKBCJFA-WUKNDPDISA-N
Complexity	196
Covalently-Bonded Unit Count	1
EC Number	610-683-2
Exact Mass	266.260965704g/mol
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	1
Monoisotopic Mass	266.260965704g/mol
Rotatable Bond Count	15
Topological Polar Surface Area	17.1Å²
X Log P3	8

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