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2,6-Diamino-3-(2,3,5-trichlorophenyl)pyrazine

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Name

2,6-Diamino-3-(2,3,5-trichlorophenyl)pyrazine

EINECS N/A
CAS No. 212778-82-0 Density 1.595 g/cm3
PSA 77.82000 LogP 4.43060
Solubility N/A Melting Point N/A
Formula C10H7Cl3N4 Boiling Point 459.041 °C at 760 mmHg
Molecular Weight 289.551 Flash Point 231.42 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 212778-82-0 (2,6-DIAMINO-3-(2,3,5-TRICHLOROPHENYL)-PYRAZINE) Hazard Symbols N/A
Synonyms

2,6-DIAMINO-3-(2,3,5-TRICHLOROPHENYL)-PYRAZINE;Elpetrigine;GW 273293;JZP 4

Article Data 1

2,6-Diamino-3-(2,3,5-trichlorophenyl)pyrazine Specification

The CAS register number of 2,6-Diamino-3-(2,3,5-trichlorophenyl)pyrazine is 212778-82-0. The systematic name about this chemical is 3-(2,3,5-trichlorophenyl)pyrazine-2,6-diamine. The molecular formula about this chemical is C10H7Cl3N4.

Physical properties about 2,6-Diamino-3-(2,3,5-trichlorophenyl)pyrazine are: (1)ACD/LogP: 2.71; (2)ACD/LogD (pH 5.5): 4; (3)ACD/LogD (pH 7.4): 4; (4)ACD/BCF (pH 5.5): 891; (5)ACD/BCF (pH 7.4): 893; (6)ACD/KOC (pH 5.5): 4495; (7)ACD/KOC (pH 7.4): 4505; (8)#H bond acceptors: 4; (9)#H bond donors: 4; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 77.82Å2; (12)Index of Refraction: 1.7; (13)Molar Refractivity: 70.185 cm3; (14)Molar Volume: 181.578 cm3; (15)Polarizability: 27.823x10-24cm3; (16)Surface Tension: 71.604 dyne/cm; (17)Enthalpy of Vaporization: 71.946 kJ/mol; (18)Boiling Point: 459.041 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1cc(c(Cl)c(Cl)c1)c2ncc(nc2N)N
(2)InChI: InChI=1/C10H7Cl3N4/c11-4-1-5(8(13)6(12)2-4)9-10(15)17-7(14)3-16-9/h1-3H,(H4,14,15,17)
(3)InChIKey: NNXUYJFHOVCRSM-UHFFFAOYAJ
(4)Std. InChI: InChI=1S/C10H7Cl3N4/c11-4-1-5(8(13)6(12)2-4)9-10(15)17-7(14)3-16-9/h1-3H,(H4,14,15,17)
(5)Std. InChIKey: NNXUYJFHOVCRSM-UHFFFAOYSA-N

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