Pyrimidine, 4-chloro-5-methyl-2-(methylthio)-


Chemical Name: Pyrimidine, 4-chloro-5-methyl-2-(methylthio)-
CAS Number: 61044-96-0
Product Number: AG00EICF(AGN-PC-0459JH)
Synonyms:
MDL No:
Molecular Formula: C6H7ClN2S
Molecular Weight: 174.6512

Identification/Properties


Computed Properties
Molecular Weight:
174.646g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
174.002g/mol
Monoisotopic Mass:
174.002g/mol
Topological Polar Surface Area:
51.1A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
112
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

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NMR Spectrum


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