Basic information
- Standard SMILES
N#CCOc1ccccc1OC(C#N)c1ccccc1- InChIKey
HJFLQLBOQDPSQQ-UHFFFAOYSA-N- Molecular formula
- C16H12N2O2
- Average molar mass
- 264.28 g/mol
Names & identifiers
- Preferred name
- 2-Phenyl-2-(2-cyanomethoxyphenoxy)acetonitrile
- IUPAC
- 2-[2-(cyanomethoxy)phenoxy]-2-phenylacetonitrile
Names & synonyms
SCHEMBL11868805HJFLQLBOQDPSQQ-UHFFFAOYSA-N2-phenyl-2-(2-cyanomethoxyphenoxy)acetonitrile
Database identifiers
- PubChem CID
- 21553967
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 66 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 386
Related reactions
2 records
Compound notes
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