3-Phenyl-1,2,4,5-tetrazine structure

3-Phenyl-1,2,4,5-tetrazine

3-phenyl-1,2,4,5-tetrazine

Also Known As: 3-phenyl-1,2,4,5-tetrazine|3-phenyl-[1,2,4,5]tetrazine|BDOSMWXSWHOGDF-UHFFFAOYSA-|980-024-4

CAS: 36022-11-4
Molecular Formula C8H6N4
Molecular Weight 158.05925 g/mol
LogP 0.3
Topological Polar Surface Area 51.6 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 4
Rotatable Bonds 1
Exact Mass 158.05925
Monoisotopic Mass 158.05925
Heavy Atoms 12
Complexity 127.0

Chemical Identifiers

CAS Number 36022-11-4
SMILES C1=CC=C(C=C1)C2=NN=CN=N2
InChIKey BDOSMWXSWHOGDF-UHFFFAOYSA-N

Product Overview

3-Phenyl-1,2,4,5-tetrazine (CAS 36022-11-4), with molecular formula C8H6N4 and molecular weight 158.05925 g/mol. IUPAC: 3-phenyl-1,2,4,5-tetrazine.

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