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2-((4-Nitrophenoxy)methyl)furan

HCID 178952003
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Basic information

CAS
91092-88-5
Standard SMILES
O=[N+]([O-])c1ccc(OCc2ccco2)cc1
InChIKey
DULPRRJPAPIWSA-UHFFFAOYSA-N
Molecular formula
C11H9NO4
Average molar mass
219.19 g/mol

Names & identifiers

Preferred name
2-((4-Nitrophenoxy)methyl)furan
IUPAC
2-[(4-nitrophenoxy)methyl]furan
English name
2-[(4-nitrophenoxy)methyl]furan
Molecular formula
C11H9NO4
Molecular weight
219.19

Names & synonyms

2-((4-Nitrophenoxy)methyl)furan91092-88-52-[(4-nitrophenoxy)methyl]furan4-(2-furylmethoxy)-1-nitrobenzeneSCHEMBL8808547MFCD10699058SBB026810STK510223AKOS005168662ST45135565Furan, 2-[(4-nitrophenoxy)methyl]-

Database identifiers

CAS
91092-88-5

Properties

Computed structural properties

XLogP
2.3
Topological polar surface area
68.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
16
Formal charge
0
Complexity
233

Physicochemical properties

Melting point
98.5 · 98.5-99 °C
Boiling point
365.2 · 365.2±22.0 °C(Predicted)
Density
1.298 · 1.298±0.06 g/cm3(Predicted)

Chemistry & industry

Suppliers2 total

Fluorochem Ltd[email protected]
PRINCETON[email protected]

Related reactions

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Compound notes

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