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Basic information
- CAS
126416-85-1- Standard SMILES
CN(C)C[C@H]1CO[C@@]2(Cc3ccccc3)CCc3ccccc3[C@@H]12- InChIKey
GJSRKXXQXWFGIF-KSEOMHKRSA-N- Molecular formula
- C22H27NO
- Average molar mass
- 321.464 g/mol
- Monoisotopic mass
- 321.20926448
Names & identifiers
- Preferred name
- 1-(3a-Benzyl-1,2,3a,4,5,9b-hexahydronaphtho[2,1-b]furan-1-yl)-N,N-dimethylmethanamine
- IUPAC
- 1-[(1S,3aR,9bR)-3a-Benzyl-1,2,3a,4,5,9b-hexahydronaphtho[2,1-b]furan-1-yl]-N,N-dimethylmethanamine
- English name
- 3-benzyl-1-(dimethylaminomethyl)-1,2,3,4,5,9-hexahydronaphtho(2-1b)furan
- Molecular formula
- C22H27NO
- Molecular weight
- 321.46
Names & synonyms
3-benzyl-1-(dimethylaminomethyl)-1,2,3,4,5,9-hexahydronaphtho(2-1b)furanNaphtho[2,1-b]furan-1-methanamine, 1,2,3a,4,5,9b-hexahydro-N,N-dimethyl-3a-(phenylmethyl)-, (1α,3aβ,9bβ)- (9CI)
Database identifiers
- CAS
126416-85-1- PubChem CID
- 124285
- DTXSID
DTXSID00925542
Properties
Physicochemical properties
- Boiling point
- 441.115 · 441.115±25.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.086 · 1.086±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 9.168 · 9.168±0.28(predicted)
Related reactions
0 records
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Compound notes
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