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1,2,4,5-Tetrazine,3,6-di-2-pyridinyl- (1671-87-0)

Identification
Name:1,2,4,5-Tetrazine,3,6-di-2-pyridinyl-
Synonyms:s-Tetrazine,3,6-di-2-pyridyl- (7CI,8CI);s-Tetrazine, di-2-pyridyl- (6CI);3,6-(2-Pyridinyl)-1,2,4,5-tetrazine;3,6-Bis(2-pyridinyl)-1,2,4,5-tetrazine;3,6-Bis(2-pyridyl)-1,2,4,5-tetrazine;3,6-Bis(2-pyridyl)-s-tetrazine;3,6-Di-2-pyridinyl-1,2,4,5-tetrazine;3,6-Di-2-pyridyl-1,2,4,5-tetrazine;3,6-Di-2-pyridyl-s-tetrazine;Bptz;NSC 238155;
CAS:1671-87-0
Molecular Formula: C12H8 N6
Molecular Weight: 236.23
InChI: InChI=1/C12H8N6/c1-3-7-13-9(5-1)11-15-17-12(18-16-11)10-6-2-4-8-14-10/h1-8H
Molecular Structure: (C12H8N6) s-Tetrazine,3,6-di-2-pyridyl- (7CI,8CI);s-Tetrazine, di-2-pyridyl- (6CI);3,6-(2-Pyridinyl)-1,2,4,5-t...
Properties
Melting Point: 225 °C (dec.)(lit.)
Flash Point: 245.7°C
Boiling Point: 509.1°Cat760mmHg
Density:1.317g/cm3
Refractive index:1.632
Specification:

The 3,6-Di(2-pyridyl)-1,2,4,5-tetrazine with the cas registry number of 1671-87-0 belongs to the product categories of Heterocyclic Compounds; Heterocyclic Building Blocks and N-Containing. This chemical is also known as 3,6-Bis(2-pyridyl)-1,2,4,5-tetrazine and 3,6-Di-2-pyridyl-s-tetrazine. Its IUPAC name and systematic name are the same which is called 3,6-Dipyridin-2-yl-1,2,4,5-tetrazine.

Physical properties about this chemical are: (1)#H bond acceptors: 6; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 2; (4)Polar Surface Area: 77.34 Å2; (5)Index of Refraction: 1.632; (6)Molar Refractivity: 63.98 cm3; (7)Molar Volume: 179.3 cm3; (8)Surface Tension: 70 dyne/cm; (9)Density: 1.317 g/cm3; (10)Flash Point: 245.7 °C; (11)Enthalpy of Vaporization: 75 kJ/mol; (12)Boiling Point: 509.1 °C at 760 mmHg; (13)Vapour Pressure: 5.59E-10 mmHg at 25°C; (14)Melting Point: 225 ºC.

Uses of 3,6-Di(2-pyridyl)-1,2,4,5-tetrazine: 4-Cyclohex-1-enyl-morpholine and 3,6-Di-pyridin-2-yl-[1,2,4,5]tetrazine can be used to produce 4alpha,5,6,7,8,8alpha-Hexahydro-4alpha-morpholino-1,4-di(2-pyridyl)phthalazine at ambient temperature. This reaction use acetonitrile as the dissolvant. The yield is about 93%.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. It may irritate to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When you want to contact it, you must be wear suitable protective clothing.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC=NC(=C1)C2=NN=C(N=N2)C3=CC=CC=N3;
(2)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;
(3)InChIKey: JFBIRMIEJBPDTQ-UHFFFAOYSA-N

Flash Point: 245.7°C
Safety Data
Hazard Symbols Xi: Irritant