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2-Pyrazinamine,5-bromo-N,N-dimethyl-

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Name

2-Pyrazinamine,5-bromo-N,N-dimethyl-

EINECS N/A
CAS No. 446286-94-8 Density 1.554 g/cm3
PSA 29.02000 LogP 1.30510
Solubility N/A Melting Point N/A
Formula C6H8BrN3 Boiling Point 265.206 °C at 760 mmHg
Molecular Weight 202.054 Flash Point 114.193 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 446286-94-8 (5-BROMO-2-(DIMETHYLAMINO)PYRAZINE) Hazard Symbols N/A
Synonyms

Pyrazinamine, 5-bromo-N,N-dimethyl-(9CI);5-bromo-N,N-dimethyl-pyrazin-2-amine;

Article Data 4

2-Pyrazinamine,5-bromo-N,N-dimethyl- Specification

The CAS registry number of 2-Pyrazinamine,5-bromo-N,N-dimethyl- is 446286-94-8. The IUPAC name is 5-bromo-N,N-dimethyl-pyrazin-2-amine. In addition, the molecular formula of is C6H8BrN3 and the molecular weight is 202.05. It is a kind of organics, and should be stored in the dry and cool environment.

The physical properties of 2-Pyrazinamine,5-bromo-N,N-dimethyl- are as following: (1)ACD/LogP: 2.40; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.404; (4)ACD/LogD (pH 7.4): 2.404; (5)ACD/BCF (pH 5.5): 39.513; (6)ACD/BCF (pH 7.4): 39.519; (7)ACD/KOC (pH 5.5): 483.656; (8)ACD/KOC (pH 7.4): 483.739; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 29.02 Å2; (13)Index of Refraction: 1.599; (14)Molar Refractivity: 44.439 cm3; (15)Molar Volume: 130.057 cm3; (16)Polarizability: 17.617×10-24cm3; (17)Surface Tension: 51.314 dyne/cm; (18)Density: 1.554 g/cm3; (19)Flash Point: 114.193 °C; (20)Enthalpy of Vaporization: 50.312 kJ/mol; (21)Boiling Point: 265.206 °C at 760 mmHg; (22)Vapour Pressure: 0.009 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CN(C)c1cnc(cn1)Br
(2)InChI: InChI=1/C6H8BrN3/c1-10(2)6-4-8-5(7)3-9-6/h3-4H,1-2H3
(3)InChIKey: FWXYKLVSUHVGKN-UHFFFAOYAS

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