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16106-44-8 | Benzenesulfonic acid, 4-methyl-, potassium salt (1:1)
CAS No: 16106-44-8 Catalog No: AG001VLY MDL No:
Product Description
Catalog Number:
AG001VLY
Chemical Name:
Benzenesulfonic acid, 4-methyl-, potassium salt (1:1)
CAS Number:
16106-44-8
Molecular Formula:
C7H7KO3S
Molecular Weight:
210.2920
IUPAC Name:
potassium;4-methylbenzenesulfonate
InChI:
InChI=1S/C7H8O3S.K/c1-6-2-4-7(5-3-6)11(8,9)10;/h2-5H,1H3,(H,8,9,10);/q;+1/p-1
InChI Key:
GHKGUEZUGFJUEJ-UHFFFAOYSA-M
SMILES:
Cc1ccc(cc1)S(=O)(=O)[O-].[K+]
EC Number:
240-273-5
UNII:
AX518O2S47
Properties
Complexity:
211
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.975g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.288g/mol
Monoisotopic Mass:
209.975g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
65.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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