Basic information
- CAS
63917-59-9- Standard SMILES
CCCC[NH+](CCCC)CCC1(c2ccccc2)C(=O)Oc2ccccc21.[Cl-]- InChIKey
MAIFJEXJCJPOCM-UHFFFAOYSA-N- Molecular formula
- C24H32ClNO2
- Average molar mass
- 402 g/mol
- Monoisotopic mass
- 401.212157
Names & identifiers
- Preferred name
- 2(3H)-Benzofuranone, 3-(2-(dibutylamino)ethyl)-3-phenyl-, hydrochloride
- IUPAC
- dibutyl-[2-(2-oxo-3-phenyl-1-benzofuran-3-yl)ethyl]azanium chloride
Names & synonyms
AP 822(3H)-BENZOFURANONE, 3-(2-(DIBUTYLAMINO)ETHYL)-3-PHENYL-, HYDROCHLORIDE63917-59-9RefChem:241465
Database identifiers
- CAS
63917-59-9- PubChem CID
- 45291
Properties
Computed structural properties
- Topological polar surface area
- 30.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 10
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 451
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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