5-chloro-2-methylsulfonylpyrimidine-4-carboxylic acid


Chemical Name: 5-chloro-2-methylsulfonylpyrimidine-4-carboxylic acid
CAS Number: 38275-34-2
Product Number: AG00CM5D(AGN-PC-0K2G6Q)
Synonyms:
MDL No:
Molecular Formula: C6H5ClN2O4S
Molecular Weight: 236.6329

Identification/Properties


Properties
Storage:
2-8℃;Keep in dry area;
Form:
Solid
Solubility:
H2O: soluble10mg/mL, clear
Computed Properties
Molecular Weight:
236.626g/mol
XLogP3:
0.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
2
Exact Mass:
235.966g/mol
Monoisotopic Mass:
235.966g/mol
Topological Polar Surface Area:
106A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
325
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:
Warning
UN#:
-
Hazard Statements:
H317-H319
Precautionary Statements:
P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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