Pyridine, 2,6-dimethyl-4-nitro-, 1-oxide supplier

Name
2,6-DIMETHYL-4-NITROPYRIDINE-1-OXIDE
EINECS
CAS No. 4808-64-4
Article Data29
CAS DataBase
Density 1.3 g/cm³
Solubility
Melting Point
Formula C₇H₈N₂O₃
Boiling Point 413.8 °C at 760 mmHg
Molecular Weight 168.152
Flash Point 204.1 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2,6-Lutidine,4-nitro-, 1-oxide (6CI,7CI,8CI);2,6-Dimethyl-4-nitropyridine 1-oxide;2,6-Dimethyl-4-nitropyridine N-oxide;4-Nitro-2,6-dimethylpyridine 1-oxide;4-Nitro-2,6-dimethylpyridine N-oxide;4-Nitro-2,6-lutidine N-oxide;NSC 5094;
PSA 71.28000
LogP 2.16330

Pyridine, 2,6-dimethyl-4-nitro-, 1-oxide Specification

This chemical is called Pyridine, 2,6-dimethyl-4-nitro-, 1-oxide, and it can also be named as 2,6-Lutidine, 4-nitro-, 1-oxide. With the molecular formula of C₇H₈N₂O₃, its molecular weight is 168.15. The CAS registry number of this chemical is 4808-64-4.

Other characteristics of the Pyridine, 2,6-dimethyl-4-nitro-, 1-oxide can be summarised as followings: (1)ACD/LogP: 0.37; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.37; (4)ACD/LogD (pH 7.4): 0.37; (5)ACD/BCF (pH 5.5): 1.12; (6)ACD/BCF (pH 7.4): 1.12; (7)ACD/KOC (pH 5.5): 37.81; (8)ACD/KOC (pH 7.4): 37.81; (9)#H bond acceptors: 5; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 69.93 Å²; (13)Index of Refraction: 1.573; (14)Molar Refractivity: 42.35 cm³; (15)Molar Volume: 128.3 cm³; (16)Polarizability: 16.78×10^-24cm³; (17)Surface Tension: 49.2 dyne/cm; (18)Density: 1.3 g/cm³; (19)Flash Point: 204.1 °C; (20)Enthalpy of Vaporization: 64.08 kJ/mol; (21)Boiling Point: 413.8 °C at 760 mmHg; (22)Vapour Pressure: 1.12E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: O=[N+]([O-])c1cc([n+]([O-])c(c1)C)C
2.InChI: InChI=1/C7H8N2O3/c1-5-3-7(9(11)12)4-6(2)8(5)10/h3-4H,1-2H3
3.InChIKey: LFPUGENPUAERSG-UHFFFAOYAV

Product Name

2,6-DIMETHYL-4-NITROPYRIDINE-1-OXIDE

Pyridine, 2,6-dimethyl-4-nitro-, 1-oxide Specification

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