Basic information
- Standard SMILES
Cc1cc2cccc([N+](=O)[O-])c2o1- InChIKey
ZUJYQWPFKJZMMN-UHFFFAOYSA-N- Molecular formula
- C9H7NO3
- Average molar mass
- 177.16 g/mol
Names & identifiers
- Preferred name
- 2-Methyl-7-nitrobenzofuran
- IUPAC
- 2-methyl-7-nitro-1-benzofuran
Names & synonyms
2-methyl-7-nitrobenzofuran13680-09-62-methyl-7-nitrobenzo[b]furanSCHEMBL7828455CHEMBL3273873ZUJYQWPFKJZMMN-UHFFFAOYSA-NMFCD18451303AKOS006373912SY502663
Database identifiers
- PubChem CID
- 13201897
- ChEMBL
CHEMBL3273873
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 59 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 213
Related reactions
8 records
Compound notes
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