8-Methoxy-2-nitronaphtho(2,3-b)furan

HCID 53429

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Basic information

CAS: 75965-79-6
Standard SMILES: COc1cccc2cc3cc([N+](=O)[O-])oc3cc12
InChIKey: VBVIYUGENXSHQJ-UHFFFAOYSA-N
Molecular formula: C13H9NO4
Average molar mass: 243.21 g/mol
Monoisotopic mass: 243.05315777

Names & identifiers

Preferred name: 8-Methoxy-2-nitronaphtho(2,3-b)furan
IUPAC: 8-methoxy-2-nitrobenzo[f][1]benzofuran

Names & synonyms

8-Methoxy-2-nitronaphtho(2,3-b)furan75965-79-6NAPHTHO(2,3-b)FURAN, 8-METHOXY-2-NITRO-8-METHOXY-2-NITRONAPHTHO[2,3-B]FURANR 71052-Nitro-8-methoxynaphtho(2,3-b)furanBRN 5750821CHEMBL7227SCHEMBL11251362DTXSID80226867

Database identifiers

CAS: 75965-79-6
PubChem CID: 53429
DTXSID: DTXSID80226867
ChEMBL: CHEMBL7227
Nikkaji: J548.010H

Properties

Computed structural properties

XLogP: 3.7
Topological polar surface area: 68.2 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 4
Rotatable bonds: 1
Heavy atoms: 18
Formal charge: 0
Complexity: 329

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