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Home > Fluorides > 1233953-06-4
1233953-06-4 | 4-(3-Fluoro-2-nitrophenoxy)tetrahydro-2H-pyran
CAS No: 1233953-06-4 Catalog No: AG01FA0H MDL No:
Product Description
Catalog Number:
AG01FA0H
Chemical Name:
4-(3-Fluoro-2-nitrophenoxy)tetrahydro-2H-pyran
CAS Number:
1233953-06-4
Molecular Formula:
C11H12FNO4
Molecular Weight:
241.2157
IUPAC Name:
4-(3-fluoro-2-nitrophenoxy)oxane
InChI:
InChI=1S/C11H12FNO4/c12-9-2-1-3-10(11(9)13(14)15)17-8-4-6-16-7-5-8/h1-3,8H,4-7H2
InChI Key:
BMVLICRCIQROQG-UHFFFAOYSA-N
SMILES:
Fc1cccc(c1[N+](=O)[O-])OC1CCOCC1
Properties
Complexity:
265
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.075g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
241.218g/mol
Monoisotopic Mass:
241.075g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
64.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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