Benzene, 1-chloro-3-methyl-5-nitro-


Chemical Name: Benzene, 1-chloro-3-methyl-5-nitro-
CAS Number: 16582-38-0
Product Number: AG001WDJ(AGN-PC-0JPG78)
Synonyms:
MDL No:
Molecular Formula: C7H6ClNO2
Molecular Weight: 171.5810

Identification/Properties


Computed Properties
Molecular Weight:
171.58g/mol
XLogP3:
2.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
171.009g/mol
Monoisotopic Mass:
171.009g/mol
Topological Polar Surface Area:
45.8A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
157
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-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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