Basic information
- CAS
72928-12-2- Standard SMILES
Cc1cn(C(CC(C)CCCC(C)(C)O)n2cc(C)c3ccccc32)c2ccccc12- InChIKey
KOIXQZAWSPOQNS-UHFFFAOYSA-N- Molecular formula
- C28H36N2O
- Average molar mass
- 416.6 g/mol
- Monoisotopic mass
- 416.28276378
Names & identifiers
- Preferred name
- 2,6-dimethyl-8,8-bis(3-methyl-1H-indol-1-yl)octan-2-ol
- IUPAC
- 2,6-dimethyl-8,8-bis(3-methylindol-1-yl)octan-2-ol
Names & synonyms
2,6-dimethyl-8,8-bis(3-methyl-1H-indol-1-yl)octan-2-olKOIXQZAWSPOQNS-UHFFFAOYSA-N
Database identifiers
- CAS
72928-12-2- PubChem CID
- 21156089
- DTXSID
DTXSID60888306- Nikkaji
- J447.263B
Properties
Computed structural properties
- XLogP
- 7
- Topological polar surface area
- 30.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 8
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 541
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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