5-Chloro-2,3,3-trimethyl-3H-benzo[g]indole
Basic information
- CAS
101851-41-6- Standard SMILES
CC1=Nc2c(cc(Cl)c3ccccc23)C1(C)C- InChIKey
FXVJJMDICFTUAK-UHFFFAOYSA-N- Molecular formula
- C15H14ClN
- Average molar mass
- 243.73 g/mol
- Monoisotopic mass
- 243.0814771
Names & identifiers
- Preferred name
- 5-Chloro-2,3,3-trimethyl-3H-benzo[g]indole
- IUPAC
- 5-chloro-2,3,3-trimethylbenzo[g]indole
Names & synonyms
DTXSID8012696215-Chloro-2,3,3-trimethyl-3H-benz[g]indole5-Chloro-2,3,3-trimethyl-3H-benzo[g]indole101851-41-6
Database identifiers
- CAS
101851-41-6- PubChem CID
- 85528061
- DTXSID
DTXSID801269621
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 12.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 347
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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