NAPHTHO(2,1-b)FURAN, 5-METHOXY-2-NITRO-
Basic information
- CAS
75965-76-3- Standard SMILES
COc1cc2oc([N+](=O)[O-])cc2c2ccccc12- InChIKey
XRGBBOFMOXFUOV-UHFFFAOYSA-N- Molecular formula
- C13H9NO4
- Average molar mass
- 243.21 g/mol
- Monoisotopic mass
- 243.05315777
Names & identifiers
- Preferred name
- NAPHTHO(2,1-b)FURAN, 5-METHOXY-2-NITRO-
- IUPAC
- 5-methoxy-2-nitrobenzo[e][1]benzofuran
- English name
- 2-Nitro-5-methoxynaphtho(2,1-b)furan
- Molecular weight
- 0
Names & synonyms
75965-76-3NAPHTHO(2,1-b)FURAN, 5-METHOXY-2-NITRO-5-Methoxy-2-nitronaphtho(2,1-b)furan5-METHOXY-2-NITRONAPHTHO[2,1-B]FURANR 72202-Nitro-5-methoxynaphtho(2,1-b)furanBRN 5750818CHEMBL266291DTXSID00226864
Database identifiers
- CAS
75965-76-3- PubChem CID
- 53426
- DTXSID
DTXSID00226864- ChEMBL
CHEMBL266291- Nikkaji
- J548.003E
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 68.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 329
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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