Nonanal, 2-(phenylmethylene)-

HCID 89284CAS 20175-19-3
Substructure searchFind similar structures

Basic information

Standard SMILES
CCCCCCCC(C=O)=Cc1ccccc1
InChIKey
VXDUTTLHVAAEFQ-UHFFFAOYSA-N
Molecular formula
C16H22O
Average molar mass
230.34 g/mol
Monoisotopic mass
230.16706532

Names & identifiers

Preferred name
Nonanal, 2-(phenylmethylene)-
IUPAC
2-benzylidenenonanal
English name
2-Benzylidenenonanal
Molecular formula
C16H22O
Molecular weight
230.35

Names & synonyms

alpha-HeptylcinnamaldehydeNonanal, 2-(phenylmethylene)-20175-19-3DTXSID2066563RefChem:854474DTXCID00362132-benzylidenenonanalHeptylcinnamaldehydea-heptylcinnamaldehydealpha-heptyl cinnamaldehydeSCHEMBL9019322

Database identifiers

CAS
20175-19-3
PubChem CID
89284
DTXSID
DTXSID2066563

Properties

Computed structural properties

XLogP
5.3
Topological polar surface area
17.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
8
Heavy atoms
17

Physicochemical properties

Odor
100 % · at 100.00 %. green leafy fruity
Odor Type
fruity
LogP
5.376 · 5.376 (est)
EPA Substance Registry System
2 · Nonanal, 2-(phenylmethylene)- (20175-19-3)
TSCA
TSCA listed

Safety & regulation

Safety data

tsca
TSCA listed

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationNonanal, 2-(phenylmethylene)-: INACTIVE

Related reactions

2 records
New reaction record

Linked notes

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