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30838-93-8

Basic Information
CAS No.: 30838-93-8
Name: 2-Chloro-4,6-dimethylpyridine
Article Data: 12
Molecular Structure:
Molecular Structure of 30838-93-8 (2-Chloro-4,6-dimethylpyridine)
Formula: C7H8ClN
Molecular Weight: 141.6
Synonyms: 2,4-Lutidine,6-chloro- (8CI);2-Chloro-4,6-lutidine;
Density: 1.114 g/cm3
Boiling Point: 208.119 °C at 760 mmHg
Flash Point: 99.11 °C
Solubility: Slightly soluble in water.
Appearance: light yellow liquid
Hazard Symbols: HarmfulXn
PSA: 12.89000
LogP: 2.35180
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Specification

The 2-Chloro-4,6-dimethylpyridine, with its CAS registry number 30838-93-8, is a kind of light yellow liquid. And its product categories are including Pyridine; Heterocyclic Compounds; Boronic Acid. When you are using, you should be careful. This chemical is harmful and may cause damage to health. 

The characteristics of 2-Chloro-4,6-dimethylpyridine are as follows: (1)ACD/LogP: 2.48; (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): 34; (6)ACD/BCF (pH 7.4): 34; (7)ACD/KOC (pH 5.5): 434; (8)ACD/KOC (pH 7.4): 434; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 12.89; (13)Index of Refraction: 1.524; (14)Molar Refractivity: 38.889 cm3; (15)Molar Volume: 127.158 cm3; (16)Polarizability: 15.417×10-24 cm3; (17)Surface Tension: 36.515 dyne/cm; (18)Density: 1.114 g/cm3; (19)Flash Point: 99.11 °C; (20)Enthalpy of Vaporization: 42.624 kJ/mol; (21)Boiling Point: 208.119 °C at 760 mmHg; (22)Vapour Pressure: 0.313 mmHg at 25°C; (23)Exact Mass: 141.034527; (24)MonoIsotopic Mass: 141.034527; (25)Topological Polar Surface Area: 12.9; (26)Heavy Atom Count: 9; (27)Complexity: 94.9.

What's more, the following datas could be converted into the molecular structure:
(1)Canonical SMILES: CC1=CC(=NC(=C1)Cl)C
(2)InChI: InChI=1S/C7H8ClN/c1-5-3-6(2)9-7(8)4-5/h3-4H,1-2H3
(3)InChIKey: COVGXNSRDOYAJD-UHFFFAOYSA-N