Basic information
- CAS
64048-53-9- Standard SMILES
CC([NH3+])CC(=O)c1c[nH]c2ccc(-c3ccccc3)cc12.[Cl-]- InChIKey
CKFUUGYZJSQNJT-UHFFFAOYSA-N- Molecular formula
- C18H19ClN2O
- Average molar mass
- 314.8 g/mol
- Monoisotopic mass
- 314.1185909
Names & identifiers
- Preferred name
- 1-Butanone, 3-amino-1-(5-phenyl-1H-indol-3-yl)-, monohydrochloride, (+-)-
- IUPAC
- [4-oxo-4-(5-phenyl-1H-indol-3-yl)butan-2-yl]azanium chloride
Names & synonyms
1-BUTANONE, 3-AMINO-1-(5-PHENYL-1H-INDOL-3-YL)-, MONOHYDROCHLORIDE, (+-)-64048-53-9RefChem:10551213-Amino-1-(5-phenyl-1H-indol-3-yl)-1-butanone monohydrochlorideDL-3-(Aminopropylene)indolyl-5-phenyl-ketone hydrochloride
Database identifiers
- CAS
64048-53-9- PubChem CID
- 46793
Properties
Computed structural properties
- Topological polar surface area
- 60.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 364
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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