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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 | Hazard Symbols | N/A | |
Synonyms |
Pyrazinamine, 5-bromo-N,N-dimethyl-(9CI);5-bromo-N,N-dimethyl-pyrazin-2-amine; |
Article Data | 4 |
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