3-ethyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine


Chemical Name: 3-ethyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine
CAS Number: 1508182-30-6
Product Number: AG01DTBE(AG01DTBE)
Synonyms:
MDL No:
Molecular Formula: C6H8N6
Molecular Weight: 164.1679

Identification/Properties


Computed Properties
Molecular Weight:
164.172g/mol
XLogP3:
-0.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
164.081g/mol
Monoisotopic Mass:
164.081g/mol
Topological Polar Surface Area:
82.5A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
162
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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