Basic information
- CAS
112738-69-9- Standard SMILES
CN(C)CCOC(=O)C1Cc2ccccc2-c2ccccc21- InChIKey
QYKCHWLAIWCVLB-UHFFFAOYSA-N- Molecular formula
- C19H21NO2
- Average molar mass
- 295.4 g/mol
- Monoisotopic mass
- 295.15722891
Names & identifiers
- Preferred name
- 2-(Dimethylamino)ethyl 9,10-dihydro-9-phenanthrenecarboxylate
- IUPAC
- 2-(dimethylamino)ethyl 9,10-dihydrophenanthrene-9-carboxylate
Names & synonyms
2-(Dimethylamino)ethyl 9,10-dihydro-9-phenanthrenecarboxylateDTXSID701183092112738-69-92-(DIMETHYLAMINO)ETHYL 9,10-DIHYDROPHENANTHRENE-9-CARBOXYLATE
Database identifiers
- CAS
112738-69-9- PubChem CID
- 14182829
- DTXSID
DTXSID701183092
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 382
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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