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CAS No.: | 155535-23-2 |
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Name: | 2-CHLORO-PYRIDO[2,3-B]PYRAZINE |
Molecular Structure: | |
Formula: | C7H4ClN3 |
Molecular Weight: | 165.582 |
Synonyms: | 3-Chloropyrido[2,3-b]pyrazine; |
Density: | 1.438 g/cm3 |
Boiling Point: | 267.036 °C at 760 mmHg |
Flash Point: | 141.065 °C |
PSA: | 38.67000 |
LogP: | 1.67820 |
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The Pyrido[2, 3-b]pyrazine, 3-chloro- has CAS registry number 155535-23-2. This chemical's molecular formula is C7H4ClN3 and molecular weight is 165.58. What's more, its systematic name is 2-Chloropyrido[2, 3-b]pyrazine.
Physical properties about Pyrido[2, 3-b]pyrazine, 3-chloro- are: (1)ACD/LogP: 1.16; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 3; (6)ACD/BCF (pH 7.4): 3; (7)ACD/KOC (pH 5.5): 78; (8)ACD/KOC (pH 7.4): 78; (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: 1.675; (14)Molar Refractivity: 43.264 cm3; (15)Molar Volume: 115.171 cm3; (16)Polarizability: 17.151×10-24 cm3; (17)Surface Tension: 66.93 dyne/cm; (18)Density: 1.438 g/cm3; (19)Flash Point: 141.065 °C; (20)Enthalpy of Vaporization: 48.469 kJ/mol; (21)Boiling Point: 267.036 °C at 760 mmHg; (22)Vapour Pressure: 0.014 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: Clc1nc2cccnc2nc1
(2) InChI: InChI=1/C7H4ClN3/c8-6-4-10-7-5(11-6)2-1-3-9-7/h1-4H
(3) InChIKey: SZRDXDOFCABQPA-UHFFFAOYAD