bis(pyridin-2-yl)-1,2,4,5-tetrazine

bis(pyridin-2-yl)-1,2,4,5-tetrazine

CAS: 1671-87-0

Formula: C12H8N6

SMILES: C1=CN=C(C=C1)C1=NN=C(N=N1)C1=NC=CC=C1

IUPAC: bis(pyridin-2-yl)-1,2,4,5-tetrazine

InChI: InChI=1S/C12H8N6/c1-3-7-13-9(5-1)11-15-17-12(18-16-11)10-6-2-4-8-14-10/h1-8H

Composition: C (61.01%), H (3.41%), N (35.58%)

Molar Mass: 236.238

Atom Count: 26

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	236.081044282
Formal Charge	0
FSP3	0
Hetero Ring Count	3
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
InChIKey	JFBIRMIEJBPDTQ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	89.19
Topological Polar Surface Area	77.34
Polarizability	25.58
Ring Count	3
Rotatable Bond Count	2

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