Benzenesulfonic acid, 4-methyl-, anhydride


Chemical Name: Benzenesulfonic acid, 4-methyl-, anhydride
CAS Number: 4124-41-8
Product Number: AG0035JE(AGN-PC-0JLQXI)
Synonyms:
MDL No:
Molecular Formula: C14H14O5S2
Molecular Weight: 326.3880

Identification/Properties


Properties
MP:
121-127 °C(lit.)
BP:
478°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;Keep in dry area;
Form:
Solid
Stability:
Moisture Sensitive
Computed Properties
Molecular Weight:
326.381g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
4
Exact Mass:
326.028g/mol
Monoisotopic Mass:
326.028g/mol
Topological Polar Surface Area:
94.3A^2
Heavy Atom Count:
21
Formal Charge:
0
Complexity:
475
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

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
1759
Hazard Statements:
H314-H290
Precautionary Statements:
P260-P280-P303+P361+P353-P301+P330+P331-P304+P340+P310-P305+P351+P338+P310
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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