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1,2,4,5-Tetrazine

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Name

1,2,4,5-Tetrazine

EINECS
CAS No. 290-96-0 Density 1.316 g/cm3
Solubility Melting Point
Formula C2H2N4 Boiling Point 217.7 °C at 760 mmHg
Molecular Weight 82.0641 Flash Point 108.1 °C
Transport Information Appearance
Safety Risk Codes
Molecular Structure Molecular Structure of 290-96-0 (1,2,4,5-Tetrazine) Hazard Symbols
Synonyms

sym-Tetrazine;s-Tetrazine(6CI,8CI);

 

1,2,4,5-Tetrazine Specification

The 1,2,4,5-Tetrazine, with the CAS registry number 290-96-0, is also known as sym-Tetrazine. This chemical's molecular formula is C2H2N4 and molecular weight is 82.0641. Its systematic name is called 1,2,4,5-tetrazine. This chemical's classification code is Mutation data.

Physical properties of 1,2,4,5-Tetrazine: (1)ACD/LogP: -1.96; (2)ACD/LogD (pH 5.5): -1.96; (3)ACD/LogD (pH 7.4): -1.96; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 2.03; (7)ACD/KOC (pH 7.4): 2.03; (8)#H bond acceptors: 4; (9)Index of Refraction: 1.509; (10)Molar Refractivity: 18.61 cm3; (11)Molar Volume: 62.3 cm3; (12)Surface Tension: 75.7 dyne/cm; (13)Density: 1.316 g/cm3; (14)Flash Point: 108.1 °C; (15)Enthalpy of Vaporization: 43.56 kJ/mol; (16)Boiling Point: 217.7 °C at 760 mmHg; (17)Vapour Pressure: 0.192 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: n1ncnnc1
(2)InChI: InChI=1/C2H2N4/c1-3-5-2-6-4-1/h1-2H
(3)InChIKey: HTJMXYRLEDBSLT-UHFFFAOYAH

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