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351003-52-6 | 4-Bromo-2-chlorobenzene-1-sulfonyl chloride
CAS No: 351003-52-6 Catalog No: AG003KW9 MDL No:MFCD03094630
Product Description
Catalog Number:
AG003KW9
Chemical Name:
4-Bromo-2-chlorobenzene-1-sulfonyl chloride
CAS Number:
351003-52-6
Molecular Formula:
C6H3BrCl2O2S
Molecular Weight:
289.9618
MDL Number:
MFCD03094630
IUPAC Name:
4-bromo-2-chlorobenzenesulfonyl chloride
InChI:
InChI=1S/C6H3BrCl2O2S/c7-4-1-2-6(5(8)3-4)12(9,10)11/h1-3H
InChI Key:
OECYEHWJPRPCOH-UHFFFAOYSA-N
SMILES:
Brc1ccc(c(c1)Cl)S(=O)(=O)Cl
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.841g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
289.952g/mol
Monoisotopic Mass:
287.841g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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