Benzene, 1-(chloromethyl)-3-(trifluoromethyl)-


Chemical Name: Benzene, 1-(chloromethyl)-3-(trifluoromethyl)-
CAS Number: 705-29-3
Product Number: AG003I7D(AGN-PC-0D4ZGF)
Synonyms:
MDL No:
Molecular Formula: C8H6ClF3
Molecular Weight: 194.5814

Identification/Properties


Properties
BP:
179.1 °C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Stability:
Lachrymatory
Refractive Index:
n20/D 1.464(lit.)
Computed Properties
Molecular Weight:
194.581g/mol
XLogP3:
3.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
194.011g/mol
Monoisotopic Mass:
194.011g/mol
Topological Polar Surface Area:
0A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
144
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:
Danger
UN#:
2920
Hazard Statements:
H226-H314
Precautionary Statements:
P280-P305+P351+P338-P310
Class:
8,3
Packing Group:

NMR Spectrum


Other Analytical Data


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