ethyl 3-chlorosulfonylpyridine-4-carboxylate


Chemical Name: ethyl 3-chlorosulfonylpyridine-4-carboxylate
CAS Number: 306936-12-9
Product Number: AG0030X1(AGN-PC-0KK7SQ)
Synonyms:
MDL No:
Molecular Formula: C8H8ClNO4S
Molecular Weight: 249.6714

Identification/Properties


Properties
BP:
376.7±27.0°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
249.665g/mol
XLogP3:
1.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
4
Exact Mass:
248.986g/mol
Monoisotopic Mass:
248.986g/mol
Topological Polar Surface Area:
81.7A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
324
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:
P280-P305+P351+P338-P310
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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