Pyrimidine, 2-(chloromethyl)-


Chemical Name: Pyrimidine, 2-(chloromethyl)-
CAS Number: 54198-88-8
Product Number: AG00DEFD(AGN-PC-00JWB1)
Synonyms:
MDL No:
Molecular Formula: C5H5ClN2
Molecular Weight: 128.5596

Identification/Properties


Computed Properties
Molecular Weight:
128.559g/mol
XLogP3:
0.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
128.014g/mol
Monoisotopic Mass:
128.014g/mol
Topological Polar Surface Area:
25.8A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
61.4
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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