Basic information
- CAS
63938-55-6- Standard SMILES
CCCC[NH2+]CCc1c[nH]c2ccccc12.[Cl-]- InChIKey
DTWINNWOBOMISB-UHFFFAOYSA-N- Molecular formula
- C14H21ClN2
- Average molar mass
- 252.78 g/mol
- Monoisotopic mass
- 252.1393264
Names & identifiers
- Preferred name
- Indole, 3-(2-(n-butylamino)ethyl)-, monohydrochloride
- IUPAC
- butyl-[2-(1H-indol-3-yl)ethyl]azanium chloride
Names & synonyms
N-Butyltryptamine hydrochlorideINDOLE, 3-(2-(n-BUTYLAMINO)ETHYL)-, MONOHYDROCHLORIDE63938-55-6RefChem:349222
Database identifiers
- CAS
63938-55-6- PubChem CID
- 45581
Properties
Computed structural properties
- Topological polar surface area
- 32.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 193
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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