Basic information
- CAS
4827-61-6- Standard SMILES
CCN(CC)CCOc1ccc([C@@H]2c3ccccc3CC[C@@H]2c2ccccc2)cc1- InChIKey
DAHJYMBFGWQBBX-VSGBNLITSA-N- Molecular formula
- C28H33NO
- Average molar mass
- 399.6 g/mol
- Monoisotopic mass
- 399.25621468
Names & identifiers
- Preferred name
- Triethylamine, 2-(p-(2-phenyl-1,2,3,4-tetrahydro-1-naphthyl)phenoxy)-, (Z)-
- IUPAC
- N,N-diethyl-2-[4-[(1R,2S)-2-phenyl-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy]ethanamine
Names & synonyms
Triethylamine, 2-(p-(2-phenyl-1,2,3,4-tetrahydro-1-naphthyl)phenoxy)-, (Z)-4827-61-6cis-2-(p-(2-Phenyl-1,2,3,4-tetrahydro-1-naphthyl)phenoxy)triethylamineDTXSID70197471N,N-Diethyl-2-{4-[(1R,2S)-2-phenyl-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy}ethan-1-amine
Database identifiers
- CAS
4827-61-6- PubChem CID
- 199738
- DTXSID
DTXSID70197471
Properties
Computed structural properties
- XLogP
- 6.7
- Topological polar surface area
- 12.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 8
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 475
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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