Home Sulfos 2-Bromo-4-methylbenzene-1-sulfonyl chloride

2-Bromo-4-methylbenzene-1-sulfonyl chloride

CAS No.:
89794-06-9
Catalog Number:
AG003ZOD
Molecular Formula:
C7H6BrClO2S
Molecular Weight:
269.5433
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Product Description
Catalog Number:
AG003ZOD
Chemical Name:
2-Bromo-4-methylbenzene-1-sulfonyl chloride
CAS Number:
89794-06-9
Molecular Formula:
C7H6BrClO2S
Molecular Weight:
269.5433
MDL Number:
MFCD08445068
IUPAC Name:
2-bromo-4-methylbenzenesulfonyl chloride
InChI:
InChI=1S/C7H6BrClO2S/c1-5-2-3-7(6(8)4-5)12(9,10)11/h2-4H,1H3
InChI Key:
NQXSKUPCOJGZQA-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(c1)Br)S(=O)(=O)Cl
Properties
Complexity:
247  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.896g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
269.537g/mol
Monoisotopic Mass:
267.896g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties