Benzenethiol, 4-(trifluoromethoxy)-


Chemical Name: Benzenethiol, 4-(trifluoromethoxy)-
CAS Number: 169685-29-4
Product Number: AG0033U5(AGN-PC-0KKY6F)
Synonyms:
MDL No:
Molecular Formula: C7H5F3OS
Molecular Weight: 194.1742

Identification/Properties


Properties
BP:
64-66°C 15mm
Storage:
Keep in dry area;2-8℃;
Form:
Liquid
Stability:
Air Sensitive/Stench
Refractive Index:
1.4745
Computed Properties
Molecular Weight:
194.171g/mol
XLogP3:
3.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
194.001g/mol
Monoisotopic Mass:
194.001g/mol
Topological Polar Surface Area:
10.2A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
140
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


NMR Spectrum


Other Analytical Data


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