Basic information
- CAS
117661-43-5- Standard SMILES
COc1cccc2c1ccc1cc([N+](=O)[O-])oc12- InChIKey
WSZXIHNALVFBNY-UHFFFAOYSA-N- Molecular formula
- C13H9NO4
- Average molar mass
- 243.21 g/mol
- Monoisotopic mass
- 243.05315777
Names & identifiers
- Preferred name
- 6-Methoxy-2-nitronaphtho(1,2-b)furan
- IUPAC
- 6-methoxy-2-nitrobenzo[g][1]benzofuran
- English name
- 6-Methoxy-2-nitronaphtho(1,2-b)furan
- Molecular formula
- C13H9NO4
- Molecular weight
- 243.21
Names & synonyms
117661-43-56-Methoxy-2-nitronaphtho(1,2-b)furan6-methoxy-2-nitronaphtho[1,2-b]furan6-methoxy-2-nitrobenzo[g][1]benzofuranNSC623722Naphtho(1,2-b)furan, 6-methoxy-2-nitro-DTXSID10922507NSC-623722Naphtho[1,2-b]furan, 6-methoxy-2-nitro-
Database identifiers
- CAS
117661-43-5- PubChem CID
- 147221
- DTXSID
DTXSID10922507
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
Physicochemical properties
- Melting point
- 224 °C · 224 °C
- Boiling point
- 420 · 420.0±25.0 °C(Predicted)
- Density
- 1.379 · 1.379±0.06 g/cm3(Predicted)
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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