CAS No.54237-53-5,6-BROMOPYRAZIN-2-AMINE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	54237-53-5
Name:	6-BROMOPYRAZIN-2-AMINE

Formula:	C₄H₄BrN₃
Molecular Weight:	174
Synonyms:	2-Amino-6-bromopyrazine;6-Bromo-2-pyrazinamine;
Density:	1.844 g/cm³
Melting Point:	136-140℃
Boiling Point:	296.3 °C at 760 mmHg
Flash Point:	133 °C
PSA:	51.80000
LogP:	1.40250

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Specification

The 2-Pyrazinamine,6-bromo- with the CAS registry number 54237-53-5 is also known as 2-Amino-6-bromopyrazine and 6-Bromo-2-pyrazinamine. The IUPAC name is 6-Bromopyrazin-2-amine. In addition, the molecular formula is C₄H₄BrN₃ and molecular weight is 174. It should be stored in a cool and dry place.

Physical properties about 2-Pyrazinamine,6-bromo- are: (1)ACD/LogP: 1.60; (2)#of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.6; (4)ACD/LogD (pH 7.4): 1.6; (5)ACD/BCF (pH 5.5): 9.67; (6)ACD/BCF (pH 7.4): 9.67; (7)ACD/KOC (pH 5.5): 176.54; (8)ACD/KOC (pH 7.4): 176.54; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 51.8 Å²; (13)Index of Refraction: 1.648; (14)Molar Refractivity: 34.36 cm³; (15)Molar Volume: 94.3 cm³; (16)Polarizability: 13.62 ×10^-24cm³; (17)Surface Tension: 68.9 dyne/cm; (18)Density: 1.844 g/cm³; (19)Flash Point: 133 °C; (20)Enthalpy of Vaporization: 53.61 kJ/mol; (21)Boiling Point: 296.3 °C at 760 mmHg; (22)Vapour Pressure: 0.00145 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: c1c(nc(cn1)Br)N
(2) InChI: InChI=1/C4H4BrN3/c5-3-1-7-2-4(6)8-3/h1-2H,(H2,6,8)
(3) InChIKey: SBBQFRYIMUUNFT-UHFFFAOYAK