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

HCID 59156
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Basic information

CAS
101931-48-0
Standard SMILES
COc1cccc2ccc3oc([N+](=O)[O-])cc3c12
InChIKey
SOPUABOYGXKWTA-UHFFFAOYSA-N
Molecular formula
C13H9NO4
Average molar mass
243.21 g/mol
Monoisotopic mass
243.05315777

Names & identifiers

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

Names & synonyms

9-Methoxy-2-nitronaphtho(2,1-b)furanNAPHTHO(2,1-b)FURAN, 9-METHOXY-2-NITRO-101931-48-09-methoxy-2-nitronaphtho[2,1-b]furanDTXSID30144365

Database identifiers

CAS
101931-48-0
PubChem CID
59156
DTXSID
DTXSID30144365

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

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Compound notes

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