5H-Tetrazol-5-one, 1-ethyl-1,2-dihydro-


Chemical Name: 5H-Tetrazol-5-one, 1-ethyl-1,2-dihydro-
CAS Number: 69048-98-2
Product Number: AG005Z5R(AGN-PC-0CSQ0T)
Synonyms:
MDL No:
Molecular Formula: C3H6N4O
Molecular Weight: 114.1059

Identification/Properties


Properties
MP:
78-80°C
Storage:
2-8℃;Inert atmosphere;
Form:
Solid
Computed Properties
Molecular Weight:
114.108g/mol
XLogP3:
0.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
114.054g/mol
Monoisotopic Mass:
114.054g/mol
Topological Polar Surface Area:
57.1A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
131
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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