7H-1,2,3-Triazolo[4,5-d]pyrimidin-7-one, 1,4-dihydro-


Chemical Name: 7H-1,2,3-Triazolo[4,5-d]pyrimidin-7-one, 1,4-dihydro-
CAS Number: 2683-90-1
Product Number: AG007MLG(AGN-PC-0O8GID)
Synonyms:
MDL No:
Molecular Formula: C4H3N5O
Molecular Weight: 137.0995

Identification/Properties


Computed Properties
Molecular Weight:
137.102g/mol
XLogP3:
-1
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
0
Exact Mass:
137.034g/mol
Monoisotopic Mass:
137.034g/mol
Topological Polar Surface Area:
83A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
190
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:
H315-H319
Precautionary Statements:
P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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