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Home > Fluorides > 1167055-58-4
1167055-58-4 | Benzene, 2-fluoro-1-methyl-3,4-dinitro-
CAS No: 1167055-58-4 Catalog No: AG000D0U MDL No:MFCD11845626
Product Description
Catalog Number:
AG000D0U
Chemical Name:
Benzene, 2-fluoro-1-methyl-3,4-dinitro-
CAS Number:
1167055-58-4
Molecular Formula:
C7H5FN2O4
Molecular Weight:
200.1240
MDL Number:
MFCD11845626
IUPAC Name:
2-fluoro-1-methyl-3,4-dinitrobenzene
InChI:
InChI=1S/C7H5FN2O4/c1-4-2-3-5(9(11)12)7(6(4)8)10(13)14/h2-3H,1H3
InChI Key:
UWOBPHMHCZNDMT-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1c(ccc(c1F)C)[N+](=O)[O-]
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.023g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
200.125g/mol
Monoisotopic Mass:
200.023g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
91.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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