Benzene, 1-(difluoromethyl)-4-nitro-


Chemical Name: Benzene, 1-(difluoromethyl)-4-nitro-
CAS Number: 29848-57-5
Product Number: AG00C1YD(AGN-PC-0JU79J)
Synonyms:
MDL No:
Molecular Formula: C7H5F2NO2
Molecular Weight: 173.1169

Identification/Properties


Computed Properties
Molecular Weight:
173.119g/mol
XLogP3:
2.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
173.029g/mol
Monoisotopic Mass:
173.029g/mol
Topological Polar Surface Area:
45.8A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
161
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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