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Home > Fluorides > 1616526-80-7
1616526-80-7 | Benzene, 1,5-difluoro-3-methyl-2-nitro-
CAS No: 1616526-80-7 Catalog No: AG001VRU MDL No:MFCD21603715
Product Description
Catalog Number:
AG001VRU
Chemical Name:
Benzene, 1,5-difluoro-3-methyl-2-nitro-
CAS Number:
1616526-80-7
Molecular Formula:
C7H5F2NO2
Molecular Weight:
173.1169
MDL Number:
MFCD21603715
IUPAC Name:
1,5-difluoro-3-methyl-2-nitrobenzene
InChI:
InChI=1S/C7H5F2NO2/c1-4-2-5(8)3-6(9)7(4)10(11)12/h2-3H,1H3
InChI Key:
YEYOQSYKJFWRNK-UHFFFAOYSA-N
SMILES:
Fc1cc(C)c(c(c1)F)[N+](=O)[O-]
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.029g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
173.119g/mol
Monoisotopic Mass:
173.029g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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