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| CAS No.: | 68707-69-7 |
|---|---|
| Name: | 2,3-DIMETHYL-4-NITROPYRIDINE |
| Article Data: | 3 |
| Molecular Structure: | |
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| Formula: | C7H8N2O2 |
| Molecular Weight: | 152.15 |
| Synonyms: | 2,3-DIMETHYL-4-NITROPYRIDINE;2,3-DIMETHYL-4-NITROYRIDINE;Dimethyl nitroyridine |
| Density: | 1.197 g/cm3 |
| Boiling Point: | 262.1 °C at 760 mmHg |
| Flash Point: | 112.3 °C |
| PSA: | 58.71000 |
| LogP: | 2.12980 |
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- Total:16 Page 1 of 1 1
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Specification
This chemical is called 2,3-Dimethyl-4-nitropyridin, and its CAS registry number is 152.15. With the molecular formula of C7H8N2O2, its molecular weight is 152.15.
Other characteristics of the 2,3-Dimethyl-4-nitropyridin can be summarised as followings: (1)ACD/LogP: 1.25; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.25; (4)ACD/LogD (pH 7.4): 1.25; (5)ACD/BCF (pH 5.5): 5.21; (6)ACD/BCF (pH 7.4): 5.21; (7)ACD/KOC (pH 5.5): 113.42; (8)ACD/KOC (pH 7.4): 113.49; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 58.71 Å2; (13)Index of Refraction: 1.551; (14)Molar Refractivity: 40.53 cm3; (15)Molar Volume: 127 cm3; (16)Polarizability: 16.07×10-24cm3; (17)Surface Tension: 46.7 dyne/cm; (18)Density: 1.197 g/cm3; (19)Flash Point: 112.3 °C; (20)Enthalpy of Vaporization: 47.97 kJ/mol; (21)Boiling Point: 262.1 °C at 760 mmHg; (22)Vapour Pressure: 0.0181 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: [O-][N+](=O)c1ccnc(c1C)C
2.InChI: InChI=1/C7H8N2O2/c1-5-6(2)8-4-3-7(5)9(10)11/h3-4H,1-2H3
3.InChIKey: WSQGOUOZNCRFNQ-UHFFFAOYAG