Home Sulfos ethyl 3-bromo-5-(chlorosulfonyl)-2-methylbenzoate

ethyl 3-bromo-5-(chlorosulfonyl)-2-methylbenzoate

CAS No.:
1498463-61-8
Catalog Number:
AG01BC0C
Molecular Formula:
C10H10BrClO4S
Molecular Weight:
341.6060
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Product Description
Catalog Number:
AG01BC0C
Chemical Name:
ethyl 3-bromo-5-(chlorosulfonyl)-2-methylbenzoate
CAS Number:
1498463-61-8
Molecular Formula:
C10H10BrClO4S
Molecular Weight:
341.6060
MDL Number:
MFCD21025394
IUPAC Name:
ethyl 3-bromo-5-chlorosulfonyl-2-methylbenzoate
InChI:
InChI=1S/C10H10BrClO4S/c1-3-16-10(13)8-4-7(17(12,14)15)5-9(11)6(8)2/h4-5H,3H2,1-2H3
InChI Key:
GNIMCQYKRSWDOK-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc(cc(c1C)Br)S(=O)(=O)Cl
Properties
Complexity:
378  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
339.917g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
341.6g/mol
Monoisotopic Mass:
339.917g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
68.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties