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Home > Fluorides > 139548-97-3
139548-97-3 | Phenol, 3,6-difluoro-2-nitro-
CAS No: 139548-97-3 Catalog No: AG001B88 MDL No:MFCD22042170
Product Description
Catalog Number:
AG001B88
Chemical Name:
Phenol, 3,6-difluoro-2-nitro-
CAS Number:
139548-97-3
Molecular Formula:
C6H3F2NO3
Molecular Weight:
175.0897
MDL Number:
MFCD22042170
IUPAC Name:
3,6-difluoro-2-nitrophenol
InChI:
InChI=1S/C6H3F2NO3/c7-3-1-2-4(8)6(10)5(3)9(11)12/h1-2,10H
InChI Key:
LDAORTVYRIJMQH-UHFFFAOYSA-N
SMILES:
Fc1ccc(c(c1O)[N+](=O)[O-])F
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.008g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
175.091g/mol
Monoisotopic Mass:
175.008g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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