Basic information
- CAS
63938-68-1- Standard SMILES
CC([NH2+]CCc1c[nH]c2ccccc12)c1ccccc1.[Cl-]- InChIKey
QOQWOGSJRUZNTM-UHFFFAOYSA-N- Molecular formula
- C18H21ClN2
- Average molar mass
- 300.8 g/mol
- Monoisotopic mass
- 300.1393264
Names & identifiers
- Preferred name
- Indole, 3-(2-(alpha-methylbenzylamino)ethyl)-, monohydrochloride
- IUPAC
- 2-(1H-indol-3-yl)ethyl-(1-phenylethyl)azanium chloride
Names & synonyms
3-(2-(alpha-Methylbenzylamino)ethyl)indole monohydrochloride63938-68-1INDOLE, 3-(2-(alpha-METHYLBENZYLAMINO)ETHYL)-, MONOHYDROCHLORIDERefChem:349210
Database identifiers
- CAS
63938-68-1- PubChem CID
- 45602
Properties
Computed structural properties
- Topological polar surface area
- 32.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 285
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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