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CAS No.: | 13535-13-2 |
---|---|
Name: | 2-AMINO-5-PHENYLPYRAZINE |
Article Data: | 11 |
Molecular Structure: | |
Formula: | C10H9N3 |
Molecular Weight: | 171.202 |
Synonyms: | Pyrazinamine,5-phenyl- (9CI);Pyrazine, 2-amino-5-phenyl- (8CI);(5-Phenylpyrazin-2-yl)amine;5-Phenyl-2-aminopyrazine;5-Phenylpyrazin-2-amine; |
Density: | 1.193 g/cm3 |
Melting Point: | 146 °C |
Boiling Point: | 339.298 °C at 760 mmHg |
Flash Point: | 185.644 °C |
Hazard Symbols: | Xn |
Risk Codes: | 22-36/38-43 |
Safety: | 22-24/25-26-36/37-39-51 |
PSA: | 51.80000 |
LogP: | 2.30700 |
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The 2-Pyrazinamine,5-phenyl- is an organic compound with the formula C10H9N3. The systematic name of this chemical is 5-phenylpyrazin-2-amine. With the CAS registry number 13535-13-2, it is also named as Pyrazine, 2-amino-5-phenyl-. The product's categories are Chloropyrazines, etc.; Pyrazines.
Physical properties about 2-Pyrazinamine,5-phenyl- are: (1)ACD/LogP: 2.31; (2)ACD/LogD (pH 5.5): 2.3; (3)ACD/LogD (pH 7.4): 2.3; (4)ACD/BCF (pH 5.5): 33.2; (5)ACD/BCF (pH 7.4): 33.23; (6)ACD/KOC (pH 5.5): 426.85; (7)ACD/KOC (pH 7.4): 427.31; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 29.02 Å2; (12)Index of Refraction: 1.633; (13)Molar Refractivity: 51.26 cm3; (14)Molar Volume: 143.4 cm3; (15)Polarizability: 20.32×10-24cm3; (16)Surface Tension: 57.3 dyne/cm; (17)Density: 1.193 g/cm3; (18)Flash Point: 185.6 °C; (19)Enthalpy of Vaporization: 58.27 kJ/mol; (20)Boiling Point: 339.3 °C at 760 mmHg; (21)Vapour Pressure: 9.28E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: n2c(c1ccccc1)cnc(N)c2
(2)InChI: InChI=1/C10H9N3/c11-10-7-12-9(6-13-10)8-4-2-1-3-5-8/h1-7H,(H2,11,13)
(3)InChIKey: KJAKXVBZQBPPOB-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C10H9N3/c11-10-7-12-9(6-13-10)8-4-2-1-3-5-8/h1-7H,(H2,11,13)
(5)Std. InChIKey: KJAKXVBZQBPPOB-UHFFFAOYSA-N