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100-87-8

100-87-8 structural image
Product Name: toluene-alpha-sulphonic acid
Formula: C7H8O3S
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CHEMICAL AND PHYSICAL PROPERTIES

Vapor Pressure 0.0000034 [mmHg]
Stability/Shelf Life TSA-94/30 WAS STABLE AGAINST CRYSTALLIZATION BELOW 50 °C
Corrosivity TSA-94/30 LESS CORROSIVE TO STAINLESS STEEL THAN 75% H3PO4
Chemical Classes Other Classes -> Organic Acids

COMPUTED DESCRIPTORS

Molecular Weight 172.20 g/mol
XLogP3 0.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 2
Exact Mass 172.01941529 g/mol
Monoisotopic Mass 172.01941529 g/mol
Topological Polar Surface Area 62.8 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 196
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes