Basic information
- CAS
36065-50-6- Standard SMILES
CC1c2ccccc2CCc2cccc(CCCN(C)C)c21- InChIKey
MMBCMSAGIIROBG-UHFFFAOYSA-N- Molecular formula
- C21H27N
- Average molar mass
- 293.4 g/mol
- Monoisotopic mass
- 293.21434987
Names & identifiers
- Preferred name
- 5H-Dibenzo(a,d)cycloheptene-4-propylamine, 10,11-dihydro-N,N,5-trimethyl-
- IUPAC
- N,N-dimethyl-3-(2-methyl-4-tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaenyl)propan-1-amine
Names & synonyms
BRN 306425110,11-Dihydro-N,N,5-trimethyl-5H-dibenzo(a,d)cycloheptene-4-propylamine36065-50-65H-DIBENZO(a,d)CYCLOHEPTENE-4-PROPYLAMINE, 10,11-DIHYDRO-N,N,5-TRIMETHYL-RefChem:305572DTXSID70957476N,N-dimethyl-3-(5-methyl-10,11-dihydro-5H-dibenzo[a,d][7]annulen-4-yl)propan-1-amine
Database identifiers
- CAS
36065-50-6- PubChem CID
- 37359
- DTXSID
DTXSID70957476- Nikkaji
- J42.179K
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 337
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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