Basic information
- CAS
121714-41-8- Standard SMILES
Cc1cncc2c3cc(O)ccc3n(C)c12- InChIKey
ZHCMFHJBNORROW-UHFFFAOYSA-N- Molecular formula
- C13H12N2O
- Average molar mass
- 212.25 g/mol
- Monoisotopic mass
- 212.09496301
Names & identifiers
- Preferred name
- 5H-Pyrido(4,3-b)indol-8-ol, 4,5-dimethyl-
- IUPAC
- 4,5-dimethylpyrido[4,3-b]indol-8-ol
Names & synonyms
5H-Pyrido(4,3-b)indol-8-ol, 4,5-dimethyl-121714-41-8DTXSID401533474,5-dimethyl-5H-pyrido[4,3-b]indol-8-ol
Database identifiers
- CAS
121714-41-8- PubChem CID
- 147696
- DTXSID
DTXSID40153347
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 38.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 271
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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