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4-[(4-Pentoxyphenyl)iminomethyl]benzonitrile

HCID 178917469
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Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
54010-32-1
Standard SMILES
CCCCCOc1ccc(N=Cc2ccc(C#N)cc2)cc1
InChIKey
ASVZIFZWQYFSOS-UHFFFAOYSA-N
Molecular formula
C19H20N2O
Average molar mass
292.4 g/mol

Names & identifiers

Preferred name
4-[(4-Pentoxyphenyl)iminomethyl]benzonitrile
IUPAC
4-[(4-pentoxyphenyl)iminomethyl]benzonitrile
English name
N-(p-Cyanobenzylidene)-p-(pentyloxy)aniline
Molecular formula
C19H20N2O
Molecular weight
292.37

Names & synonyms

54010-32-1SCHEMBL12417132N-(p-Cyanobenzylidene)-p-(pentyloxy)anilineBenzonitrile, 4-[[[4-(pentyloxy)phenyl]imino]methyl]-

Database identifiers

CAS
54010-32-1

Properties

Computed structural properties

XLogP
4.7
Topological polar surface area
45.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
7
Heavy atoms
22
Formal charge
0
Complexity
368

Chemistry & industry

Suppliers2 total

WAKO[email protected]
3B Scientific Corporation[email protected]

Related reactions

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Compound notes

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