Benzene, 1-chloro-3-(methylsulfonyl)-


Chemical Name: Benzene, 1-chloro-3-(methylsulfonyl)-
CAS Number: 21383-00-6
Product Number: AG003JB7(AGN-PC-0KKM1X)
Synonyms:
MDL No: MFCD00474659
Molecular Formula: C14H12Cl2O2S
Molecular Weight: 315.2149

Identification/Properties


Properties
MP:
108-109℃
Form:
Solid
Computed Properties
Molecular Weight:
190.641g/mol
XLogP3:
2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
189.986g/mol
Monoisotopic Mass:
189.986g/mol
Topological Polar Surface Area:
42.5A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
217
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:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P280-P301+P312-P302+P352-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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