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2-[(2-Fluoro-6-nitrophenoxy)methyl]tetrahydrofuran

HCID 53255752
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Basic information

CAS
1233952-73-2
Standard SMILES
O=[N+]([O-])c1cccc(F)c1OCC1CCCO1
InChIKey
DSLODFITPQPLPU-UHFFFAOYSA-N
Molecular formula
C11H12FNO4
Average molar mass
241.22 g/mol
Monoisotopic mass
241.07503603

Names & identifiers

Preferred name
2-[(2-Fluoro-6-nitrophenoxy)methyl]tetrahydrofuran
IUPAC
2-[(2-fluoro-6-nitrophenoxy)methyl]oxolane
English name
2-[(2-fluoro-6-nitrophenoxy)methyl]tetrahydrofuran
Molecular formula
C11H12FNO4
Molecular weight
241.22

Names & synonyms

2-[(2-fluoro-6-nitrophenoxy)methyl]tetrahydrofuran1233952-73-22-[(2-fluoro-6-nitrophenoxy)methyl]oxolaneMFCD17014085DTXSID301229165AKOS026671626KS-5552F0636482-[(2-fluoro-6-nitro-phenoxy)methyl]tetrahydrofuranFuran, 2-[(2-fluoro-6-nitrophenoxy)methyl]tetrahydro-

Database identifiers

CAS
1233952-73-2
PubChem CID
53255752
DTXSID
DTXSID301229165

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
64.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
17
Formal charge
0
Complexity
271

Physicochemical properties

Boiling point
377 · 377.0±22.0 °C(Predicted)
Density
1.301 · 1.301±0.06 g/cm3(Predicted)

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