Basic information
- CAS
35142-04-2- Standard SMILES
COc1cccc2c1ccc1ccc3c(c12)OCO3- InChIKey
WYZHCCJSWRPBPI-UHFFFAOYSA-N- Molecular formula
- C16H12O3
- Average molar mass
- 252.26 g/mol
- Monoisotopic mass
- 252.07864424
Names & identifiers
- Preferred name
- 8-Methoxyphenanthro[3,4-d][1,3]dioxole
- IUPAC
- 8-methoxynaphtho[2,1-g][1,3]benzodioxole
Names & synonyms
35142-04-28-methoxyphenanthro[3,4-d][1,3]dioxoleNSC87409DTXSID80293150NSC-874098-Methoxy-2H-phenanthro[3,4-d][1,3]dioxole
Database identifiers
- CAS
35142-04-2- PubChem CID
- 258487
- DTXSID
DTXSID80293150
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 27.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 332
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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