Basic information
- CAS
14233-72-8- Standard SMILES
N#CCCOc1ccc2ccccc2c1- InChIKey
HDOAQRQSTGWBTP-UHFFFAOYSA-N- Molecular formula
- C13H11NO
- Average molar mass
- 197.23 g/mol
- Monoisotopic mass
- 197.08406397
Names & identifiers
- Preferred name
- Propanenitrile, 3-(2-naphthalenyloxy)-
- IUPAC
- 3-naphthalen-2-yloxypropanenitrile
Names & synonyms
Propanenitrile, 3-(2-naphthalenyloxy)-14233-72-8DTXSID50384241RefChem:374534DTXCID203352653-naphthalen-2-yloxypropanenitrileMaybridge1_002257SCHEMBL11634195SCHEMBL31588905HMS547O13AKOS0001856313-[(Naphthalen-2-yl)oxy]propanenitrile
Database identifiers
- CAS
14233-72-8- PubChem CID
- 2801397
- DTXSID
DTXSID50384241- Nikkaji
- J708.417J
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 33 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 242
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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