Name: 7-Bromopyrido[2,3-b]pyrazine
SKU: 52333-42-3

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Basic Information

Molecular Structure:
CAS No.:	52333-42-3
Name:	7-Bromopyrido[2,3-b]pyrazine

Formula:	C₇H₄BrN₃
Molecular Weight:	210.033
Synonyms:	7-Bromopyrido[2,3-b]pyrazine;
Density:	1.758 g/cm³
Melting Point:	161-166°C
Boiling Point:	293.9 °C at 760 mmHg
Flash Point:	131.5 °C
Hazard Symbols:	Xn
Risk Codes:	22-36/37/38
Safety:	26
PSA:	38.67000
LogP:	1.78730

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Specification

The 7-Bromopyrido[2,3-b]pyrazine is an organic compound with the formula C₇H₄BrN₃. The IUPAC name of this chemical is 7-bromopyrido[2,3-b]pyrazine. With the CAS registry number 52333-42-3, it is also named as Pyrido[2,3-b]pyrazine, 7-bromo-. The product's categories are Halides; Fused Ring Systems; Building Blocks; Quinoxaline.

Physical properties about 7-Bromopyrido[2,3-b]pyrazine are: (1)ACD/LogP: 0.95; (2)ACD/LogD (pH 5.5): 0.94; (3)ACD/LogD (pH 7.4): 0.94; (4)ACD/BCF (pH 5.5): 3.08; (5)ACD/BCF (pH 7.4): 3.08; (6)ACD/KOC (pH 5.5): 77.79; (7)ACD/KOC (pH 7.4): 77.79; (8)#H bond acceptors: 3; (9)Polar Surface Area: 38.67 Å²; (10)Index of Refraction: 1.698; (11)Molar Refractivity: 46.05 cm³; (12)Molar Volume: 119.4 cm³; (13)Polarizability: 18.25×10^-24cm³; (14)Surface Tension: 68.9 dyne/cm; (15)Density: 1.758 g/cm³; (16)Flash Point: 131.5 °C; (17)Enthalpy of Vaporization: 51.21 kJ/mol; (18)Boiling Point: 293.9 °C at 760 mmHg; (19)Vapour Pressure: 0.00295 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Brc1cc2nccnc2nc1
(2)InChI: InChI=1/C7H4BrN3/c8-5-3-6-7(11-4-5)10-2-1-9-6/h1-4H
(3)InChIKey: YEDMUIQRKXNDQI-UHFFFAOYAG
(4)Std. InChI: InChI=1S/C7H4BrN3/c8-5-3-6-7(11-4-5)10-2-1-9-6/h1-4H
(5)Std. InChIKey: YEDMUIQRKXNDQI-UHFFFAOYSA-N