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| CAS No.: | 607373-83-1 |
|---|---|
| Name: | 2-Chloro-4-methoxy-5-nitropyridine |
| Molecular Structure: | |
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| Formula: | C6H5ClN2O3 |
| Molecular Weight: | 188.57 |
| Synonyms: | 2-Chloro-4-methoxy-5-nitropyridine;2-Chloro-4-Methoxy-5-Nitro Pyridine; |
| Density: | 1.445g/cm3 |
| Boiling Point: | 311.6 °C at 760 mmHg |
| Flash Point: | 142.3 °C |
| PSA: | 67.94000 |
| LogP: | 2.17500 |
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Specification
The Pyridine,2-chloro-4-methoxy-5-nitro-, with CAS registry number 607373-83-1, has the systematic name of 2-chloro-4-methoxy-5-nitro-pyridine. Besides this, it is also called 2-Chloro-4-methoxy-5-nitropyridine. And the chemical formula of this chemical is C6H5ClN2O3.
Physical properties of Pyridine,2-chloro-4-methoxy-5-nitro-: (1)ACD/LogP: 1.66; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.66; (4)ACD/LogD (pH 7.4): 1.66; (5)#H bond acceptors: 5; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 2; (8)Polar Surface Area: 67.94 Å2; (9)Index of Refraction: 1.564; (10)Molar Refractivity: 42.46 cm3; (11)Molar Volume: 130.4 cm3; (12)Polarizability: 16.83×10-24cm3; (13)Surface Tension: 51.4 dyne/cm; (14)Density: 1.445 g/cm3; (15)Flash Point: 142.3 °C; (16)Enthalpy of Vaporization: 53.05 kJ/mol; (17)Boiling Point: 311.6 °C at 760 mmHg; (18)Vapour Pressure: 0.00102 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: COc1cc(ncc1[N+](=O)[O-])Cl
(2)InChI: InChI=1/C6H5ClN2O3/c1-12-5-2-6(7)8-3-4(5)9(10)11/h2-3H,1H3
(3)InChIKey: IDLQBYAYVNBGGL-UHFFFAOYAW
(4)Std. InChI: InChI=1S/C6H5ClN2O3/c1-12-5-2-6(7)8-3-4(5)9(10)11/h2-3H,1H3
(5)Std. InChIKey: IDLQBYAYVNBGGL-UHFFFAOYSA-N