9-Methyl-2,3,4,4A,9,9A-hexahydro-1H-carbazole
Basic information
- CAS
1775-89-9- Standard SMILES
CN1c2ccccc2C2CCCCC21- InChIKey
UTPYETKWQRRWAF-UHFFFAOYSA-N- Molecular formula
- C13H17N
- Average molar mass
- 187.28 g/mol
- Monoisotopic mass
- 187.13609955
Names & identifiers
- Preferred name
- 9-Methyl-2,3,4,4A,9,9A-hexahydro-1H-carbazole
- IUPAC
- 9-methyl-1,2,3,4,4a,9a-hexahydrocarbazole
Names & synonyms
NSC3521001775-89-9SCHEMBL10399177SCHEMBL11350931DTXSID60319948NSC-3521009-METHYL-2,3,4,4A,9,9A-HEXAHYDRO-1H-CARBAZOLE
Database identifiers
- CAS
1775-89-9- PubChem CID
- 336793
- DTXSID
DTXSID60319948
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 213
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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