Basic information
- CAS
61-29-0- Standard SMILES
CCCCN1CC2Cc3cc(OC)c(OC)cc3C2C1.Cl- InChIKey
SOBHPRCIZAYEBQ-UHFFFAOYSA-N- Molecular formula
- C17H26ClNO2
- Average molar mass
- 311.8 g/mol
- Monoisotopic mass
- 311.1652068
Names & identifiers
- Preferred name
- Indeno(1,2-c)pyrrole, 2-butyl-1,2,3,3a,8,8a-hexahydro-5,6-dimethoxy-, hydrochloride (1:1)
- IUPAC
- 2-butyl-6,7-dimethoxy-3,3a,4,8b-tetrahydro-1H-indeno[1,2-c]pyrrole;hydrochloride
Names & synonyms
61-29-0RefChem:1087282Indeno(1,2-c)pyrrole, 2-butyl-1,2,3,3a,8,8a-hexahydro-5,6-dimethoxy-, hydrochloride (1:1)Indeno(1,2-c)pyrrole, 1,2,3,3a,8,8a-hexahydro-2-butyl-5,6-dimethoxy-, hydrochlorideDTXSID009764731,2,3,3a,8,8a-Hexahydro-2-butyl-5,6-dimethoxyindeno(1,2-c)pyrrole hydrochloride2-Butyl-6,7-dimethoxy-3,3a,4,8b-tetrahydro-1H-indeno(2,1-c)pyrrole hydrochloride2-Butyl-5,6-dimethoxy-1,2,3,3a,8,8a-hexahydroindeno[1,2-c]pyrrole--hydrogen chloride (1/1)
Database identifiers
- CAS
61-29-0- PubChem CID
- 6085
- DTXSID
DTXSID00976473
Properties
Computed structural properties
- Topological polar surface area
- 21.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 322
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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