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108097-04-7

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Basic Information
CAS No.: 108097-04-7
Name: 2-CHLORO-3,8-DIMETHYLQUINOLINE
Molecular Structure:
Molecular Structure of 108097-04-7 (2-CHLORO-3,8-DIMETHYLQUINOLINE)
Formula: C11H10ClN
Molecular Weight: 191.66
Synonyms: 2-Chloro-3,8-dimethylquinoline;
Density: 1.188 g/cm3
Boiling Point: 305.179 °C at 760 mmHg
Flash Point: 167.014 °C
Risk Codes: 41
Safety: 26-39
PSA: 12.89000
LogP: 3.50500
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Specification

The CAS register number of Quinoline,2-chloro-3,8-dimethyl- is 108097-04-7. The IUPAC name about this chemical is 2-chloro-3,8-dimethylquinoline. The molecular formula about this chemical is C11H10ClN and the molecular weight is 191.66.

Physical properties about Quinoline,2-chloro-3,8-dimethyl- are: (1)ACD/LogP: 3.90; (2)ACD/LogD (pH 5.5): 4; (3)ACD/LogD (pH 7.4): 4; (4)ACD/BCF (pH 5.5): 338; (5)ACD/BCF (pH 7.4): 338; (6)ACD/KOC (pH 5.5): 2248; (7)ACD/KOC (pH 7.4): 2248; (8)#H bond acceptors: 1; (9)Polar Surface Area: 12.89 Å2; (10)Index of Refraction: 1.621; (11)Molar Refractivity: 56.732 cm3; (12)Molar Volume: 161.274 cm3; (13)Polarizability: 22.49x10-24cm3; (14)Surface Tension: 44.446 dyne/cm; (15)Density: 1.188 g/cm3; (16)Flash Point: 167.014 °C; (17)Enthalpy of Vaporization: 52.381 kJ/mol; (18)Boiling Point: 305.179 °C at 760 mmHg; (19)Vapour Pressure: 0.002 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cc1cccc2cc(C)c(Cl)nc12
(2)InChI: InChI=1/C11H10ClN/c1-7-4-3-5-9-6-8(2)11(12)13-10(7)9/h3-6H,1-2H3
(3)InChIKey: NVTHPPOUFJQHDY-UHFFFAOYAL
(4)Std. InChI: InChI=1S/C11H10ClN/c1-7-4-3-5-9-6-8(2)11(12)13-10(7)9/h3-6H,1-2H3
(5)Std. InChIKey: NVTHPPOUFJQHDY-UHFFFAOYSA-N