Benzenesulfonothioic acid, S-phenyl ester


Chemical Name: Benzenesulfonothioic acid, S-phenyl ester
CAS Number: 1212-08-4
Product Number: AG003UEW(AGN-PC-0JLA3C)
Synonyms:
MDL No:
Molecular Formula: C12H10O2S2
Molecular Weight: 250.3366

Identification/Properties


Properties
MP:
36-53 °C(lit.)
BP:
125 °C(Press: 0.01 Torr)
Storage:
Room Temperature;Keep in dry area;
Form:
Solid
Computed Properties
Molecular Weight:
250.33g/mol
XLogP3:
3.2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
250.012g/mol
Monoisotopic Mass:
250.012g/mol
Topological Polar Surface Area:
67.8A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
294
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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