Benzenesulfonic acid, 4-methyl-, compd. with pyridine (1:1)


Chemical Name: Benzenesulfonic acid, 4-methyl-, compd. with pyridine (1:1)
CAS Number: 24057-28-1
Product Number: AG003U2P(AGN-PC-0JPN4I)
Synonyms:
MDL No:
Molecular Formula: C12H13NO3S
Molecular Weight: 251.3015

Identification/Properties


Properties
MP:
117-120 °C
BP:
442.7 °C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Stability:
Moisture Sensitive
Refractive Index:
1.6000 (estimate)
Computed Properties
Molecular Weight:
251.3g/mol
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
251.062g/mol
Monoisotopic Mass:
251.062g/mol
Topological Polar Surface Area:
79.7A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
224
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:
Warning
UN#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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