5-Bromo-6-chloro-4(1H)-pyrimidinone


Chemical Name: 5-Bromo-6-chloro-4(1H)-pyrimidinone
CAS Number: 89089-19-0
Product Number: AG00878W(AGN-PC-0WAB7H)
Synonyms:
MDL No:
Molecular Formula: C4H2BrClN2O
Molecular Weight: 209.4285

Identification/Properties


Computed Properties
Molecular Weight:
209.427g/mol
XLogP3:
1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
207.904g/mol
Monoisotopic Mass:
207.904g/mol
Topological Polar Surface Area:
41.5A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
211
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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