Home Sulfos 2-bromo-5-chloro-4-methoxy-3-nitrobenzene-1-sulfonyl chloride

2-bromo-5-chloro-4-methoxy-3-nitrobenzene-1-sulfonyl chloride

CAS No.:
1384430-41-4
Catalog Number:
AG019YSQ
Molecular Formula:
C7H4BrCl2NO5S
Molecular Weight:
364.9854
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Product Description
Catalog Number:
AG019YSQ
Chemical Name:
2-bromo-5-chloro-4-methoxy-3-nitrobenzene-1-sulfonyl chloride
CAS Number:
1384430-41-4
Molecular Formula:
C7H4BrCl2NO5S
Molecular Weight:
364.9854
MDL Number:
MFCD22369808
IUPAC Name:
2-bromo-5-chloro-4-methoxy-3-nitrobenzenesulfonyl chloride
InChI:
InChI=1S/C7H4BrCl2NO5S/c1-16-7-3(9)2-4(17(10,14)15)5(8)6(7)11(12)13/h2H,1H3
InChI Key:
LJAQYVVYZNLRCO-UHFFFAOYSA-N
SMILES:
COc1c(Cl)cc(c(c1[N+](=O)[O-])Br)S(=O)(=O)Cl
Properties
Complexity:
394  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
362.837g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
364.975g/mol
Monoisotopic Mass:
362.837g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
97.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties