5-Amino-2-hexyloxybenzonitrile

HCID 22227906
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Basic information

Standard SMILES
CCCCCCOc1ccc(N)cc1C#N
InChIKey
PGWFPEMLRWEYTI-UHFFFAOYSA-N
Molecular formula
C13H18N2O
Average molar mass
218.29 g/mol

Names & identifiers

Preferred name
5-Amino-2-hexyloxybenzonitrile
IUPAC
5-amino-2-hexoxybenzonitrile

Names & synonyms

5-Amino-2-hexyloxybenzonitrileSCHEMBL60526465-amino-2-n-hexyloxybenzonitrilePGWFPEMLRWEYTI-UHFFFAOYSA-NAKOS010521889

Database identifiers

PubChem CID
22227906

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
59 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
16

Related reactions

4 records
New reaction record

Compound notes

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