1-(4-bromobutyl)-2-phenyl-1H-indole
Basic information
- CAS
875455-09-7- Standard SMILES
BrCCCCn1c(-c2ccccc2)cc2ccccc21- InChIKey
AIMPVEKHCVUJKG-UHFFFAOYSA-N- Molecular formula
- C18H18BrN
- Average molar mass
- 328.2 g/mol
- Monoisotopic mass
- 327.06226
Names & identifiers
- Preferred name
- 1-(4-bromobutyl)-2-phenyl-1H-indole
- IUPAC
- 1-(4-bromobutyl)-2-phenylindole
Names & synonyms
1-(4-bromobutyl)-2-phenyl-1H-indole875455-09-7SCHEMBL4939569DTXSID70740103AIMPVEKHCVUJKG-UHFFFAOYSA-N
Database identifiers
- CAS
875455-09-7- PubChem CID
- 69249082
- DTXSID
DTXSID70740103
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 4.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 287
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…