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

HCID 53425
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Basic information

CAS
75965-75-2
Standard SMILES
COc1ccc2ccc3oc([N+](=O)[O-])cc3c2c1
InChIKey
GUDGYQZVOAXJLS-UHFFFAOYSA-N
Molecular formula
C13H9NO4
Average molar mass
243.21 g/mol
Monoisotopic mass
243.05315777

Names & identifiers

Preferred name
8-Methoxy-2-nitronaphtho(2,1-b)furan
IUPAC
8-methoxy-2-nitrobenzo[e][1]benzofuran
English name
2-nitro-8-methoxynaphtho(2,1-b)furan
Molecular formula
C13H9NO4
Molecular weight
243.21

Names & synonyms

75965-75-22-Nitro-8-methoxynaphtho(2,1-b)furan8-methoxy-2-nitronaphtho[2,1-b]furan8-Methoxy-2-nitronaphtho(2,1-b)furanNSC-329225NAPHTHO(2,1-b)FURAN, 8-METHOXY-2-NITRO-W7EE265MZTDTXSID40226863Naphtho[2,1-b]furan, 8-methoxy-2-nitro-2-NITRO-8-METHOXYNAPHTHO[2,1-B]FURANRefChem:88694DTXCID70149354
Show more names
nitro-2 methoxy-8 naphtofuranne
CHEMBL269488NSC3292258-Methoxy-2-nitro-naphtho[2,1-b]furanNSC 329225BRN 50582152-Nitro-8-methoxy-naphtho(2,1-b)furanR 6998SCHEMBL11247108

Database identifiers

CAS
75965-75-2
PubChem CID
53425
DTXSID
DTXSID40226863
ChEMBL
CHEMBL269488
UNII
W7EE265MZT
Nikkaji
J548.004C

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

Boiling point
386.08 °C · 386.08°C (rough estimate)
Density
1.2929 · 1.2929 (rough estimate)
refractive index
1.588 · 1.5880 (estimate)

Related reactions

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Compound notes

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