4-Methoxy-2-nitro-1-benzofuran
Basic information
- CAS
40024-27-9- Standard SMILES
COc1cccc2oc([N+](=O)[O-])cc12- InChIKey
ROUXCCFGPIJYIN-UHFFFAOYSA-N- Molecular formula
- C9H7NO4
- Average molar mass
- 193.16 g/mol
- Monoisotopic mass
- 193.0375077
Names & identifiers
- Preferred name
- 4-Methoxy-2-nitro-1-benzofuran
- IUPAC
- 4-methoxy-2-nitro-1-benzofuran
Names & synonyms
4-methoxy-2-nitro-1-benzofuranNSC17071940024-27-94-methoxy-2-nitro-benzofuranSCHEMBL29163740DTXSID70305413NSC-170719
Database identifiers
- CAS
40024-27-9- PubChem CID
- 298528
- DTXSID
DTXSID70305413
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 68.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 227
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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