Basic information
- CAS
1440535-41-0- Standard SMILES
CNC(C#N)c1ccc(OC)cc1.Cl- InChIKey
OAAQONBUFMTPPB-UHFFFAOYSA-N- Molecular formula
- C10H13ClN2O
- Average molar mass
- 212.67 g/mol
- Monoisotopic mass
- 212.0716407
Names & identifiers
- Preferred name
- 2-(4-Methoxyphenyl)-2-(methylamino)acetonitrile hydrochloride
- IUPAC
- 2-(4-methoxyphenyl)-2-(methylamino)acetonitrile;hydrochloride
Names & synonyms
1440535-41-02-(4-methoxyphenyl)-2-(methylamino)acetonitrile hydrochloride2-(4-methoxyphenyl)-2-(methylamino)acetonitrile;hydrochloride2-(4-Methoxyphenyl)-2-(methylamino)-acetonitrile hydrochlorideMFCD24386213AKOS030245801CS-10095
Database identifiers
- CAS
1440535-41-0- PubChem CID
- 91664038
Properties
Computed structural properties
- Topological polar surface area
- 45.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 188
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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