6-Methoxy-2-nitronaphtho(2,1-b)furan

HCID 59155

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Basic information

CAS: 101931-47-9
Standard SMILES: COc1cccc2c1ccc1oc([N+](=O)[O-])cc12
InChIKey: RTXLIXBBJFJDMK-UHFFFAOYSA-N
Molecular formula: C13H9NO4
Average molar mass: 243.21 g/mol
Monoisotopic mass: 243.05315777

Names & identifiers

Preferred name: 6-Methoxy-2-nitronaphtho(2,1-b)furan
IUPAC: 6-methoxy-2-nitrobenzo[e][1]benzofuran

Names & synonyms

6-Methoxy-2-nitronaphtho(2,1-b)furan101931-47-9NAPHTHO(2,1-b)FURAN, 6-METHOXY-2-NITRO-6-methoxy-2-nitronaphtho[2,1-b]furanSCHEMBL11093874DTXSID70144364

Database identifiers

CAS: 101931-47-9
PubChem CID: 59155
DTXSID: DTXSID70144364

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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