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| CAS No.: | 68236-03-3 |
|---|---|
| Name: | 6-chloropyrido[3,2-b]pyrazine |
| Molecular Structure: | |
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| Formula: | C7H4ClN3 |
| Molecular Weight: | 165.58 |
| Synonyms: | 6-Chloropyrido[2,3-b]pyrazine; |
| Density: | 1.437 g/cm3 |
| Melting Point: | 159 °C(Solv: ligroine (8032-32-4)) |
| Boiling Point: | 286.4 °C at 760 mmHg |
| Flash Point: | 154.3 °C |
| PSA: | 38.67000 |
| LogP: | 1.67820 |
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Specification
The 6-Chloropyrido[3,2-b]pyrazine with the cas number 68236-03-3 is also called Pyrido[2,3-b]pyrazine,6-chloro-. Its molecular formula is C7H4ClN3. The product category is chiral chemicals. This chemical is a kind of organics. It should be stored in dry and cool environment.
The properties of the chemical are: (1)ACD/LogP: 0.79; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.79; (4)ACD/LogD (pH 7.4): 0.79; (5)ACD/BCF (pH 5.5): 2.36; (6)ACD/BCF (pH 7.4): 2.36; (7)ACD/KOC (pH 5.5): 64.4; (8)ACD/KOC (pH 7.4): 64.4; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 38.67 Å2; (13)Index of Refraction: 1.674; (14)Molar Refractivity: 43.26 cm3; (15)Molar Volume: 115.1 cm3; (16)Polarizability: 17.15×10-24cm3; (17)Surface Tension: 66.9 dyne/cm; (18)Enthalpy of Vaporization: 50.44 kJ/mol; (19)Vapour Pressure: 0.00457 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc1nc2nccnc2cc1
(2)InChI: InChI=1/C7H4ClN3/c8-6-2-1-5-7(11-6)10-4-3-9-5/h1-4H
(3)InChIKey: WHKACFUJNYOJPD-UHFFFAOYAG