Mls003170757
Basic information
- CAS
69267-54-5- Standard SMILES
O=[N+]([O-])c1cc2c(ccc3occc32)o1- InChIKey
CIZQUNGDZXJWAU-UHFFFAOYSA-N- Molecular formula
- C10H5NO4
- Average molar mass
- 203.15 g/mol
- Monoisotopic mass
- 203.02185764
Names & identifiers
- Preferred name
- Mls003170757
- IUPAC
- 2-nitrofuro[3,2-e][1]benzofuran
Names & synonyms
MLS00317075769267-54-5DTXSID70318346RefChem:357334DTXCID102694692-nitrobenzo[1,2-b:4,3-b']difuranNSC329125CHEMBL2360144NSC-329125SMR001874675
Database identifiers
- CAS
69267-54-5- PubChem CID
- 332389
- DTXSID
DTXSID70318346- ChEMBL
CHEMBL2360144
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 72.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 277
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Related reactions
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Compound notes
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