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1-Methyl-1H-Tetrazole [16681-77-9]

 
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Identification
Copyright
CAS # 16681-77-9, 1-Methyl-1H-Tetrazole
Name
1-Methyl-1H-Tetrazole
Synonyms
1-Methyl-1,2,3,4-Tetrazole; Zero/005912; Zinc06072451
Molecular Formula
C2H4N4
Molecular Weight 84.08
CAS Registry Number
16681-77-9
SMILES
C1=NN=N[N]1C
InChI
1S/C2H4N4/c1-6-2-3-4-5-6/h2H,1H3
InChIKey OMAFFHIGWTVZOH-UHFFFAOYSA-N
down Properties
Desity 1.41g/cm3 (Cal.)
Boiling point 171.324°C at 760 mmHg (Cal.)
Flash point 57.415°C (Cal.)
down References
(1) Luke A. Burke, Richard N. Butler and John C. Stephens. Theoretical characterization of pentazole anion with metal counter ions. Calculated and experimental N shifts of aryldiazonium, -azide and -pentazole systems, J. Chem. Soc., Perkin Trans. 2, 2001, 0, 1679.
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