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CAS No.: | 54957-86-7 |
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Name: | 2,3-DICHLORO-6-PICOLINE |
Article Data: | 3 |
Molecular Structure: | |
Formula: | C6H5Cl2N |
Molecular Weight: | 162.018 |
Synonyms: | 2,3-Dichlor-6-methyl-pyridin;2,3-DICHLORO-6-PICOLINE;2,3-dichloro-6-methyl-pyridine;Pyridine,2,3-dichloro-6-methyl; |
Density: | 1.319g/cm3 |
Boiling Point: | 208.1 °C at 760 mmHg |
Flash Point: | 99.1 °C |
Hazard Symbols: | T |
Risk Codes: | 25 |
Safety: | 45 |
PSA: | 12.89000 |
LogP: | 2.69680 |
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The Pyridine,2,3-dichloro-6-methyl-, with CAS registry number 54957-86-7, belongs to the following product category: Pyridine. It has the systematic name of 2,3-dichloro-6-methylpyridine. Besides this, it is also called 2,3-Dichloro-6-picoline. And the chemical formula of this chemical is C6H5Cl2N.
Physical properties of Pyridine,2,3-dichloro-6-methyl-: (1)ACD/LogP: 2.58; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.58; (4)ACD/LogD (pH 7.4): 2.58; (5)ACD/BCF (pH 5.5): 53.38; (6)ACD/BCF (pH 7.4): 53.38; (7)ACD/KOC (pH 5.5): 599.91; (8)ACD/KOC (pH 7.4): 599.91; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 12.89 Å2; (13)Index of Refraction: 1.547; (14)Molar Refractivity: 38.95 cm3; (15)Molar Volume: 122.8 cm3; (16)Polarizability: 15.44×10-24cm3; (17)Surface Tension: 40.9 dyne/cm; (18)Density: 1.319 g/cm3; (19)Flash Point: 99.1 °C; (20)Enthalpy of Vaporization: 42.62 kJ/mol; (21)Boiling Point: 208.1 °C at 760 mmHg; (22)Vapour Pressure: 0.313 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Cc1ccc(Cl)c(Cl)n1
(2)InChI: InChI=1/C6H5Cl2N/c1-4-2-3-5(7)6(8)9-4/h2-3H,1H3
(3)InChIKey: BRJDBTSPHZWCBU-UHFFFAOYAT
(4)Std. InChI: InChI=1S/C6H5Cl2N/c1-4-2-3-5(7)6(8)9-4/h2-3H,1H3
(5)Std. InChIKey: BRJDBTSPHZWCBU-UHFFFAOYSA-N