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874801-47-5 | 2-Bromo-4-chloro-5-fluorobenzenesulfonyl chloride
CAS No: 874801-47-5 Catalog No: AG01EY1V MDL No:MFCD05664917
Product Description
Catalog Number:
AG01EY1V
Chemical Name:
2-Bromo-4-chloro-5-fluorobenzenesulfonyl chloride
CAS Number:
874801-47-5
Molecular Formula:
C6H2BrCl2FO2S
Molecular Weight:
307.9523
MDL Number:
MFCD05664917
IUPAC Name:
2-bromo-4-chloro-5-fluorobenzenesulfonyl chloride
InChI:
InChI=1S/C6H2BrCl2FO2S/c7-3-1-4(8)5(10)2-6(3)13(9,11)12/h1-2H
InChI Key:
RQBUYKWEMDXLCL-UHFFFAOYSA-N
SMILES:
Clc1cc(Br)c(cc1F)S(=O)(=O)Cl
Properties
Complexity:
279
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.832g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
307.942g/mol
Monoisotopic Mass:
305.832g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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