Basic information
- CAS
698379-18-9- Standard SMILES
COc1ccccc1-c1nc2ccc([N+](=O)[O-])cc2o1- InChIKey
UFOUARFMCFYGOE-UHFFFAOYSA-N- Molecular formula
- C14H10N2O4
- Average molar mass
- 270.24 g/mol
- Monoisotopic mass
- 270.0640568
Names & identifiers
- Preferred name
- 2-(2-Methoxyphenyl)-6-nitro-1,3-benzoxazole
- IUPAC
- 2-(2-methoxyphenyl)-6-nitro-1,3-benzoxazole
Names & synonyms
2-(2-Methoxyphenyl)-6-nitro-1,3-benzoxazole698379-18-9DTXSID50680513RefChem:250832DTXCID50631262AKOS0163623802-(2'-methoxyphenyl)-6-nitrobenzo[d]oxazole
Database identifiers
- CAS
698379-18-9- PubChem CID
- 52904875
- DTXSID
DTXSID50680513
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 81.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 360
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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