(E,Z)-2,13-Octadecadienal

Catalog Number	ACM99577578
CAS	99577-57-8
Structure
IUPAC Name	(2E,13Z)-octadeca-2,13-dienal
Synonyms	(2E,13Z)-octadeca-2,13-dienal;(E,Z)-2,13-OCTADECADIENAL;2E,13Z-Octadecadienal;99577-57-8;Koiganal II;SCHEMBL1302654;CHEBI:167965;LMFA06000234;ZINC21982904;AKOS015959073
Molecular Weight	264.4g/mol
Molecular Formula	C18H32O
Canonical SMILES	CCCCC=CCCCCCCCCCC=CC=O
InChI	InChI=1S/C18H32O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h5-6,16-18H,2-4,7-15H2,1H3/b6-5-,17-16+
InChI Key	NCFULMZVHNTQOK-RAPDCGKPSA-N
Purity	96%
Complexity	228
Covalently-Bonded Unit Count	1
EC Number	619-445-2
Exact Mass	264.245315640g/mol
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	1
Monoisotopic Mass	264.245315640g/mol
Rotatable Bond Count	14
Topological Polar Surface Area	17.1Å²
X Log P3	7.1

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