4-Isoxazolesulfonyl chloride, 3,5-dimethyl-


Chemical Name: 4-Isoxazolesulfonyl chloride, 3,5-dimethyl-
CAS Number: 80466-79-1
Product Number: AG003IP1(AGN-PC-0KK7QL)
Synonyms:
MDL No: MFCD00052554
Molecular Formula: C5H6ClNO3S
Molecular Weight: 195.6240

Identification/Properties


Properties
MP:
39-40 °C
BP:
310.8°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Stability:
Moisture Sensitive
Computed Properties
Molecular Weight:
195.617g/mol
XLogP3:
1.2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
194.976g/mol
Monoisotopic Mass:
194.976g/mol
Topological Polar Surface Area:
68.6A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
235
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#:
3265
Hazard Statements:
H314
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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