Benzenesulfonic acid, monohydrate


Chemical Name: Benzenesulfonic acid, monohydrate
CAS Number: 26158-00-9
Product Number: AG002RW9(AGN-PC-00PZ56)
Synonyms:
MDL No:
Molecular Formula: C6H8O4S
Molecular Weight: 176.1903

Identification/Properties


Properties
MP:
42-49 °C(lit.)
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
176.186g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
176.014g/mol
Monoisotopic Mass:
176.014g/mol
Topological Polar Surface Area:
63.8A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
184
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:
2
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
2585
Hazard Statements:
H302+H312+H332-H314
Precautionary Statements:
P280-P305+P351+P338-P310
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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