Basic information
- CAS
63917-66-8- Standard SMILES
C[NH+](C)CCC1(c2ccccc2)C(=O)Oc2ccccc21.[Cl-]- InChIKey
FPGUWEPNTKKYLI-UHFFFAOYSA-N- Molecular formula
- C18H20ClNO2
- Average molar mass
- 317.8 g/mol
- Monoisotopic mass
- 317.1182566
Names & identifiers
- Preferred name
- 2(3H)-Benzofuranone, 3-(2-(dimethylamino)ethyl)-3-phenyl-, hydrochloride
- IUPAC
- dimethyl-[2-(2-oxo-3-phenyl-1-benzofuran-3-yl)ethyl]azanium chloride
Names & synonyms
AP 452(3H)-BENZOFURANONE, 3-(2-(DIMETHYLAMINO)ETHYL)-3-PHENYL-, HYDROCHLORIDE63917-66-8RefChem:241468
Database identifiers
- CAS
63917-66-8- PubChem CID
- 45305
Properties
Computed structural properties
- Topological polar surface area
- 30.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 375
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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