Basic information
- CAS
188412-57-9- Standard SMILES
CCCCCCCc1c(C)c(OC)c(OC)c2c1[nH]c1ccccc12- InChIKey
IPDBZJZDENIFBG-UHFFFAOYSA-N- Molecular formula
- C22H29NO2
- Average molar mass
- 339.5 g/mol
- Monoisotopic mass
- 339.21982917
Names & identifiers
- Preferred name
- 1-heptyl-3,4-dimethoxy-2-methyl-9H-carbazole
- IUPAC
- 1-heptyl-3,4-dimethoxy-2-methyl-9H-carbazole
Names & synonyms
1-heptyl-3,4-dimethoxy-2-methyl-9H-carbazole188412-57-99H-Carbazole, 1-heptyl-3,4-dimethoxy-2-methyl-CHEMBL4061769SCHEMBL13424607DTXSID80455211
Database identifiers
- CAS
188412-57-9- PubChem CID
- 11099863
- DTXSID
DTXSID80455211- ChEMBL
CHEMBL4061769- Nikkaji
- J813.232A
Properties
Computed structural properties
- XLogP
- 7.2
- Topological polar surface area
- 34.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 8
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 401
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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