Basic information
- Standard SMILES
COc1cc(C2CO2)ccc1C#N- InChIKey
ZHJZZQRBOUWVQI-UHFFFAOYSA-N- Molecular formula
- C10H9NO2
- Average molar mass
- 175.18 g/mol
Names & identifiers
- Preferred name
- 2-Methoxy-4-(oxiran-2-yl)benzonitrile
- IUPAC
- 2-methoxy-4-(oxiran-2-yl)benzonitrile
Names & synonyms
2-methoxy-4-(oxiran-2-yl)benzonitrile1255207-21-6SCHEMBL286396ZHJZZQRBOUWVQI-UHFFFAOYSA-NAKOS0063720012-(methyloxy)-4-oxiran-2-ylbenzonitrileDA-13502
Database identifiers
- PubChem CID
- 55296759
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 45.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 232
Related reactions
12 records
Compound notes
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