3,5-dichloro-1H-pyrazin-2-one


Chemical Name: 3,5-dichloro-1H-pyrazin-2-one
CAS Number: 130879-62-8
Product Number: AG000V23(AGN-PC-03LDXD)
Synonyms:
MDL No:
Molecular Formula: C4H2Cl2N2O
Molecular Weight: 164.9775

Identification/Properties


Computed Properties
Molecular Weight:
164.973g/mol
XLogP3:
1.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
163.954g/mol
Monoisotopic Mass:
163.954g/mol
Topological Polar Surface Area:
41.5A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
209
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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