(5E,7Z)-Dodeca-5,7-dienal

Catalog Number	ACM75539650
CAS	75539-65-0
Structure
IUPAC Name	(5E,7Z)-dodeca-5,7-dienal
Synonyms	5E,7Z-Dodecadienal;(5E,7Z)-dodeca-5,7-dienal;75539-65-0;E5,Z7-dodecadienal;(e,z)-5,7-dodecadienal;SCHEMBL811318;LMFA06000157;ZINC44135119
Molecular Weight	180.29g/mol
Molecular Formula	C12H20O
Canonical SMILES	CCCCC=CC=CCCCC=O
InChI	InChI=1S/C12H20O/c1-2-3-4-5-6-7-8-9-10-11-12-13/h5-8,12H,2-4,9-11H2,1H3/b6-5-,8-7+
InChI Key	LDQDYNHCLZNOFB-IGTJQSIKSA-N
Purity	96%
Complexity	157
Covalently-Bonded Unit Count	1
Exact Mass	180.151415257g/mol
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	1
Monoisotopic Mass	180.151415257g/mol
Rotatable Bond Count	8
Topological Polar Surface Area	17.1Å²
X Log P3	3.5

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