Pyrazinecarboxylic acid, 3-amino-5,6-dichloro-, methyl ester


Chemical Name: Pyrazinecarboxylic acid, 3-amino-5,6-dichloro-, methyl ester
CAS Number: 1458-18-0
Product Number: AG001DFH(AGN-PC-0JLB7W)
Synonyms:
MDL No:
Molecular Formula: C6H5Cl2N3O2
Molecular Weight: 222.0288

Identification/Properties


Properties
MP:
227-230 °C
BP:
357.3 °C at 760 mmHg
Storage:
2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
222.025g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
220.976g/mol
Monoisotopic Mass:
220.976g/mol
Topological Polar Surface Area:
78.1A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
204
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

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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