Benzene, 1-methyl-2-nitro-3-(trifluoromethyl)-


Chemical Name: Benzene, 1-methyl-2-nitro-3-(trifluoromethyl)-
CAS Number: 92891-23-1
Product Number: AG00GVXO(AGN-PC-00MMQL)
Synonyms:
MDL No:
Molecular Formula: C8H6F3NO2
Molecular Weight: 205.1339

Identification/Properties


Properties
Storage:
2-8℃;
Computed Properties
Molecular Weight:
205.136g/mol
XLogP3:
3.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
0
Exact Mass:
205.035g/mol
Monoisotopic Mass:
205.035g/mol
Topological Polar Surface Area:
45.8A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
224
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#:
-
Hazard Statements:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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