3-<WBR>Chloro-<WBR>4-<WBR>methylbenzenesulfonyl chloride


Chemical Name: 3-<WBR>Chloro-<WBR>4-<WBR>methylbenzenesulfonyl chloride
CAS Number: 42413-03-6
Product Number: AG0072HV(AGN-PC-0WAFQ5)
Synonyms:
MDL No:
Molecular Formula: C7H6Cl2O2S
Molecular Weight: 225.0923

Identification/Properties


Computed Properties
Molecular Weight:
225.083g/mol
XLogP3:
3.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
223.947g/mol
Monoisotopic Mass:
223.947g/mol
Topological Polar Surface Area:
42.5A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
245
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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