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Structure

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

CAS
75539-65-0
Catalog Number
ACM75539650
Category
Insect Pheromone
Molecular Weight
180.29g/mol
Molecular Formula
C12H20O

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Specification

Synonyms
5E,7Z-Dodecadienal;(5E,7Z)-dodeca-5,7-dienal;75539-65-0;E5,Z7-dodecadienal;(e,z)-5,7-dodecadienal;SCHEMBL811318;LMFA06000157;ZINC44135119
IUPAC Name
(5E,7Z)-dodeca-5,7-dienal
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
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
17.1Ų
XLogP3
3.5
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