3-(5-Hydroxymethyl-2-methoxy-phenoxy)-benzonitrile

HCID 57701119
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Basic information

Standard SMILES
COc1ccc(CO)cc1Oc1cccc(C#N)c1
InChIKey
OWELOFBNSYDKGD-UHFFFAOYSA-N
Molecular formula
C15H13NO3
Average molar mass
255.27 g/mol

Names & identifiers

Preferred name
3-(5-Hydroxymethyl-2-methoxy-phenoxy)-benzonitrile
IUPAC
3-[5-(hydroxymethyl)-2-methoxyphenoxy]benzonitrile

Names & synonyms

SCHEMBL3988471OWELOFBNSYDKGD-UHFFFAOYSA-N3-(5-Hydroxymethyl-2-methoxy-phenoxy)-benzonitrile

Database identifiers

PubChem CID
57701119

Properties

Computed structural properties

XLogP
2.3
Topological polar surface area
62.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
19

Related reactions

2 records
New reaction record

Compound notes

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