1-hydroxy-N-methylcarbazole
Basic information
- CAS
3449-61-4- Standard SMILES
Cn1c2ccccc2c2cccc(O)c21- InChIKey
BCDHBQLNRAQGHR-UHFFFAOYSA-N- Molecular formula
- C13H11NO
- Average molar mass
- 197.23 g/mol
- Monoisotopic mass
- 197.08406397
Overview
a major metabolite of N-methylcarbazole; structure in first source
Names & identifiers
- Preferred name
- 1-hydroxy-N-methylcarbazole
- IUPAC
- 9-methylcarbazol-1-ol
- English name
- 9H-Carbazol-1-ol, 9-methyl-
- Molecular formula
- C13H11NO
- Molecular weight
- 197.23
Names & synonyms
1-Hydroxy-N-methylcarbazole3449-61-41-OH-Nmc9H-Carbazol-1-ol, 9-methyl-DTXSID90188043RefChem:907630DTXCID201105349-Methylcarbazol-1-ol9-Methyl-9H-carbazol-1-ol1-Hydroxy-N-methylcabazoleCarbazol-1-ol, 9-methyl-1-hydroxy-9-methylcarbazole
Show more names
N-Methyl-1-hydroxycarbazoleSCHEMBL5964412SCHEMBL269308109-Methyl-9H-carbazol-1-ol #BCDHBQLNRAQGHR-UHFFFAOYSA-N
Database identifiers
- CAS
3449-61-4- PubChem CID
- 145689
- DTXSID
DTXSID90188043- Nikkaji
- J588.582E
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 25.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 243
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Related reactions
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Compound notes
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