Benzene, 1,2,3-trichloro-5-nitro-


Chemical Name: Benzene, 1,2,3-trichloro-5-nitro-
CAS Number: 20098-48-0
Product Number: AG002D4B(AGN-PC-0JLXDI)
Synonyms:
MDL No:
Molecular Formula: C6H2Cl3NO2
Molecular Weight: 226.4446

Identification/Properties


Computed Properties
Molecular Weight:
226.437g/mol
XLogP3:
3.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
224.915g/mol
Monoisotopic Mass:
224.915g/mol
Topological Polar Surface Area:
45.8A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
172
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-H312-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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