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Home > Fluorides > 141516-49-6
141516-49-6 | Benzene, 1-(2-fluoro-2-phenylethoxy)-4-nitro-
CAS No: 141516-49-6 Catalog No: AG001GJ9 MDL No:
Product Description
Catalog Number:
AG001GJ9
Chemical Name:
Benzene, 1-(2-fluoro-2-phenylethoxy)-4-nitro-
CAS Number:
141516-49-6
Molecular Formula:
C14H12FNO3
Molecular Weight:
261.2484
IUPAC Name:
1-(2-fluoro-2-phenylethoxy)-4-nitrobenzene
InChI:
InChI=1S/C14H12FNO3/c15-14(11-4-2-1-3-5-11)10-19-13-8-6-12(7-9-13)16(17)18/h1-9,14H,10H2
InChI Key:
BRQSMHZEVSMREM-UHFFFAOYSA-N
SMILES:
FC(c1ccccc1)COc1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
281
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.08g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
261.252g/mol
Monoisotopic Mass:
261.08g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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