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CAS No.: | 60010-03-9 |
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Name: | 2,6-Dichloro-4-methyl-3-nitropyridine |
Article Data: | 11 |
Molecular Structure: | |
Formula: | C6H4Cl2N2O2 |
Molecular Weight: | 207.016 |
Synonyms: | 2,6-Dichloro-4-methyl-3-nitropyridine; |
Density: | 1.537 g/cm3 |
Boiling Point: | 316.924 °C at 760 mmHg |
Flash Point: | 145.471 °C |
PSA: | 58.71000 |
LogP: | 3.12820 |
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This chemical is called 2,6-Dichloro-4-methyl-3-nitropyridine, and it can also be named as pyridine, 2,6-dichloro-4-methyl-3-nitro-. With the molecular formula of C6H4Cl2N2O2, its molecular weight is 207.01. The CAS registry number of this chemical is 60010-03-9, and its product category is API Intermediates.
Other characteristics of the 2,6-Dichloro-4-methyl-3-nitropyridine can be summarised as followings: (1)ACD/LogP: 2.31; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 29; (6)ACD/BCF (pH 7.4): 29; (7)ACD/KOC (pH 5.5): 388; (8)ACD/KOC (pH 7.4): 388; (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: 1.591; (14)Molar Refractivity: 45.505 cm3; (15)Molar Volume: 134.675 cm3; (16)Polarizability: 18.039×10-24cm3; (17)Surface Tension: 54.719 dyne/cm; (18)Density: 1.537 g/cm3; (19)Flash Point: 145.471 °C; (20)Enthalpy of Vaporization: 53.606 kJ/mol; (21)Boiling Point: 316.924 °C at 760 mmHg; (22)Vapour Pressure: 0.001 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: O=N(=O)c1c(C)cc(Cl)nc1Cl
2.InChI: InChI=1/C6H4Cl2N2O2/c1-3-2-4(7)9-6(8)5(3)10(11)12/h2H,1H3
3.InChIKey: CMJNIYUZFQWYCK-UHFFFAOYAL