1-[(2-chloroethyl)sulfanyl]-3-(trifluoromethyl)benzene


Chemical Name: 1-[(2-chloroethyl)sulfanyl]-3-(trifluoromethyl)benzene
CAS Number: 448967-32-6
Product Number: AG00I8H5(AGN-00I8BL)
Synonyms:
MDL No:
Molecular Formula: C9H8ClF3S
Molecular Weight: 240.6730

Identification/Properties


Computed Properties
Molecular Weight:
240.668g/mol
XLogP3:
4.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
239.999g/mol
Monoisotopic Mass:
239.999g/mol
Topological Polar Surface Area:
25.3A^2
Heavy Atom Count:
14
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


NMR Spectrum


Other Analytical Data


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