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Home Sulfos sodium 3,5-dichloro-4-methylbenzene-1-sulfonate

sodium 3,5-dichloro-4-methylbenzene-1-sulfonate

CAS No.:
5042-19-3
Catalog Number:
AG01B6NS
Molecular Formula:
C7H5Cl2NaO3S
Molecular Weight:
263.0736
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Product Description
Catalog Number:
AG01B6NS
Chemical Name:
sodium 3,5-dichloro-4-methylbenzene-1-sulfonate
CAS Number:
5042-19-3
Molecular Formula:
C7H5Cl2NaO3S
Molecular Weight:
263.0736
MDL Number:
MFCD00024918
IUPAC Name:
sodium;3,5-dichloro-4-methylbenzenesulfonate
InChI:
InChI=1S/C7H6Cl2O3S.Na/c1-4-6(8)2-5(3-7(4)9)13(10,11)12;/h2-3H,1H3,(H,10,11,12);/q;+1/p-1
InChI Key:
KCTRSGKCDDQTLJ-UHFFFAOYSA-M
SMILES:
Cc1c(Cl)cc(cc1Cl)S(=O)(=O)[O-].[Na+]
Properties
Complexity:
265  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.923g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
263.064g/mol
Monoisotopic Mass:
261.923g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
65.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties