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Home > Bromides > 1208076-76-9
1208076-76-9 | 4-Bromo-2-chloro-6-methylbenzenesulfonyl chloride
CAS No: 1208076-76-9 Catalog No: AG01F96Y MDL No:MFCD12026182
Product Description
Catalog Number:
AG01F96Y
Chemical Name:
4-Bromo-2-chloro-6-methylbenzenesulfonyl chloride
CAS Number:
1208076-76-9
Molecular Formula:
C7H5BrCl2O2S
Molecular Weight:
303.9884
MDL Number:
MFCD12026182
IUPAC Name:
4-bromo-2-chloro-6-methylbenzenesulfonyl chloride
InChI:
InChI=1S/C7H5BrCl2O2S/c1-4-2-5(8)3-6(9)7(4)13(10,11)12/h2-3H,1H3
InChI Key:
CQIZRHKFBDNPJP-UHFFFAOYSA-N
SMILES:
Brc1cc(C)c(c(c1)Cl)S(=O)(=O)Cl
Properties
Complexity:
275
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.857g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
303.979g/mol
Monoisotopic Mass:
301.857g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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