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Home > Fluorides > 141412-60-4
141412-60-4 | 1,4-Difluoro-2-methyl-5-nitrobenzene
CAS No: 141412-60-4 Catalog No: AG003DOB MDL No:MFCD06200905
Product Description
Catalog Number:
AG003DOB
Chemical Name:
1,4-Difluoro-2-methyl-5-nitrobenzene
CAS Number:
141412-60-4
Molecular Formula:
C7H5F2NO2
Molecular Weight:
173.1169
MDL Number:
MFCD06200905
IUPAC Name:
1,4-difluoro-2-methyl-5-nitrobenzene
InChI:
InChI=1S/C7H5F2NO2/c1-4-2-6(9)7(10(11)12)3-5(4)8/h2-3H,1H3
InChI Key:
ABWWQMGGJXKGBL-UHFFFAOYSA-N
SMILES:
Fc1cc([N+](=O)[O-])c(cc1C)F
NSC Number:
25759
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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