Basic Information | Post buying leads | Suppliers |
Name |
2-Pyrazinamine, 3,5-dimethyl- |
EINECS | N/A |
CAS No. | 91678-81-8 | Density | 1.112 g/cm3 |
PSA | 51.80000 | LogP | 1.25680 |
Solubility | N/A | Melting Point |
96 °C |
Formula | C6H9N3 | Boiling Point | 243.457 °C at 760 mmHg |
Molecular Weight | 123.158 | Flash Point | 124.314 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | 22 | |
Molecular Structure | Hazard Symbols | Xn | |
Synonyms |
Pyrazinamine,3,5-dimethyl- (9CI);Pyrazine, 2-amino-3,5-dimethyl- (6CI);2-Amino-3,5-dimethylpyrazine;3,5-Dimethylpyrazin-2-amine; |
This chemical is called 2-Pyrazinamine, 3,5-dimethyl-, and its systematic name is 3,5-dimethylpyrazin-2-amine. With the molecular formula of C6H9N3, its molecular weight is 123.16. The CAS registry number of this chemical is 91678-81-8. Additionally, its product categories are Amines; Pyrazines, Pyrimidines & Pyridazines.
Other characteristics of the 2-Pyrazinamine, 3,5-dimethyl- can be summarised as followings: (1)ACD/LogP: 0.29; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.279; (4)ACD/LogD (pH 7.4): 0.289; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 33.42; (8)ACD/KOC (pH 7.4): 34.223; (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: 1.57; (14)Molar Refractivity: 36.321 cm3; (15)Molar Volume: 110.711 cm3; (16)Polarizability: 14.399×10-24cm3; (17)Surface Tension: 51.577 dyne/cm; (18)Density: 1.112 g/cm3; (19)Flash Point: 124.314 °C; (20)Enthalpy of Vaporization: 48.048 kJ/mol; (21)Boiling Point: 243.457 °C at 760 mmHg; (22)Vapour Pressure: 0.032 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: Cc1cnc(c(n1)C)N
2.InChI: InChI=1/C6H9N3/c1-4-3-8-6(7)5(2)9-4/h3H,1-2H3,(H2,7,8)
3.InChIKey: GZZRWBRYYZGTNW-UHFFFAOYAZ