1H-Benzimidazole,2-[[(4-chloro-3,5-dimethyl-2-pyridinyl)methyl]sulfinyl]-5-methoxy-


Chemical Name: 1H-Benzimidazole,2-[[(4-chloro-3,5-dimethyl-2-pyridinyl)methyl]sulfinyl]-5-methoxy-
CAS Number: 863029-89-4
Product Number: AG004MRO(AGN-PC-0V3V96)
Synonyms:
MDL No:
Molecular Formula: C16H16ClN3O2S
Molecular Weight: 349.8351

Identification/Properties


Properties
MP:
74-78°C
BP:
597.9±60.0 °C(Predicted)
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
349.833g/mol
XLogP3:
2.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
4
Exact Mass:
349.065g/mol
Monoisotopic Mass:
349.065g/mol
Topological Polar Surface Area:
87.1A^2
Heavy Atom Count:
23
Formal Charge:
0
Complexity:
442
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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