Benzenethiol, 3-(trifluoromethyl)-


Chemical Name: Benzenethiol, 3-(trifluoromethyl)-
CAS Number: 937-00-8
Product Number: AG0033HD(AGN-PC-0JMP2D)
Synonyms:
MDL No:
Molecular Formula: C7H5F3S
Molecular Weight: 178.1748

Identification/Properties


Properties
BP:
72 °C
Storage:
2-8℃;
Form:
Liquid
Stability:
Stench
Refractive Index:
1.49
Computed Properties
Molecular Weight:
178.172g/mol
XLogP3:
3.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
0
Exact Mass:
178.006g/mol
Monoisotopic Mass:
178.006g/mol
Topological Polar Surface Area:
1A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
132
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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