Phenanthren-3-ol-4b,5,6,7,8,8a-13C6
Basic information
- Standard SMILES
Oc1ccc2cc[13c]3[13cH][13cH][13cH][13cH][13c]3c2c1- InChIKey
NGPOABOEXMDQBT-JOCKUXRRSA-N- Molecular formula
- C14H10O
- Average molar mass
- 200.18 g/mol
- Monoisotopic mass
- 200.09329395
Names & identifiers
- Preferred name
- Phenanthren-3-ol-4b,5,6,7,8,8a-13C6
- IUPAC
- phenanthren-3-ol
Names & synonyms
DTXSID701356922Phenanthren-3-ol-4b,5,6,7,8,8a-13C6
Database identifiers
- PubChem CID
- 73057263
- DTXSID
DTXSID701356922
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 225
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…