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Home > Fluorides > 1356114-13-0
1356114-13-0 | 3-(3-Fluoro-2-nitrophenoxy)oxetane
CAS No: 1356114-13-0 Catalog No: AG01FE59 MDL No:
Product Description
Catalog Number:
AG01FE59
Chemical Name:
3-(3-Fluoro-2-nitrophenoxy)oxetane
CAS Number:
1356114-13-0
Molecular Formula:
C9H8FNO4
Molecular Weight:
213.1625
IUPAC Name:
3-(3-fluoro-2-nitrophenoxy)oxetane
InChI:
InChI=1S/C9H8FNO4/c10-7-2-1-3-8(9(7)11(12)13)15-6-4-14-5-6/h1-3,6H,4-5H2
InChI Key:
YZQAYZMTFLCZQH-UHFFFAOYSA-N
SMILES:
Fc1cccc(c1[N+](=O)[O-])OC1COC1
Properties
Complexity:
241
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.044g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
213.164g/mol
Monoisotopic Mass:
213.044g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
64.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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