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| CAS No.: | 66909-36-2 |
|---|---|
| Name: | 6-chloro-2-methylnicotinonitrile |
| Article Data: | 9 |
| Molecular Structure: | |
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| Formula: | C7H5ClN2 |
| Molecular Weight: | 152.583 |
| Synonyms: | 2-Chloro-6-methyl-5-pyridinecarbonitrile;6-Chloro-2-methylnicotinonitrile;6-Chloro-2-methylpyridine-3-carbonitrile; |
| EINECS: | -0 |
| Density: | 1.269 g/cm3 |
| Melting Point: | 106-110 °C |
| Boiling Point: | 246.462 °C at 760 mmHg |
| Flash Point: | 102.857 °C |
| PSA: | 36.68000 |
| LogP: | 1.91508 |
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Specification
The 3-Pyridinecarbonitrile,6-chloro-2-methyl-, with the CAS registry number 66909-36-2, belongs to the product category of Pyridine Series. This chemical's molecular formula is C7H5ClN2 and molecular weight is 152.58. Its systematic name is called 6-chloro-2-methylpyridine-3-carbonitrile.
Physical properties of 3-Pyridinecarbonitrile,6-chloro-2-methyl-: (1)ACD/LogP: 1.80; (2)ACD/LogD (pH 5.5): 2; (3)ACD/LogD (pH 7.4): 2; (4)ACD/BCF (pH 5.5): 9; (5)ACD/BCF (pH 7.4): 9; (6)ACD/KOC (pH 5.5): 172; (7)ACD/KOC (pH 7.4): 172; (8)#H bond acceptors: 2; (9)Index of Refraction: 1.555; (10)Molar Refractivity: 38.569 cm3; (11)Molar Volume: 120.236 cm3; (12)Surface Tension: 52.715 dyne/cm; (13)Density: 1.269 g/cm3; (14)Flash Point: 102.857 °C; (15)Enthalpy of Vaporization: 48.358 kJ/mol; (16)Boiling Point: 246.462 °C at 760 mmHg; (17)Vapour Pressure: 0.027 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: N#Cc1ccc(Cl)nc1C
(2)InChI: InChI=1/C7H5ClN2/c1-5-6(4-9)2-3-7(8)10-5/h2-3H,1H3
(3)InChIKey: PCDPITLPCWBXRB-UHFFFAOYAZ