Name: ethyl 4-chloro-8-methoxy-quinoline-3-carboxylate
SKU: 27568-05-4

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Basic Information

Molecular Structure:
CAS No.:	27568-05-4
Name:	ethyl 4-chloro-8-methoxy-quinoline-3-carboxylate
Article Data:	7

Formula:	C₁₃H₁₂ClNO₃
Molecular Weight:	265.696
Synonyms:	4-Chloro-8-methoxy-3-quinolinecarboxylicacid ethyl ester;Ethyl 4-chloro-8-methoxy-3-quinolinecarboxylate;NSC 196906;
Density:	1.282 g/cm³
Melting Point:	77-78 °C
Boiling Point:	366.9 °C at 760 mmHg
Flash Point:	175.7 °C
PSA:	48.42000
LogP:	3.07350

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Specification

The CAS register number of 3-Quinolinecarboxylicacid, 4-chloro-8-methoxy-, ethyl ester is 27568-05-4. It also can be called as 4-Chloro-8-methoxy-3-quinolinecarboxylicacid ethyl ester and the IUPAC name about this chemical is ethyl 4-chloro-8-methoxyquinoline-3-carboxylate. The molecular formula about this chemical is C₁₃H₁₂ClNO₃ and the molecular weight is 265.69618.

Physical properties about 3-Quinolinecarboxylicacid, 4-chloro-8-methoxy-, ethyl ester are: (1)ACD/LogP: 2.88; (2)#H bond acceptors: 4; (3)#Freely Rotating Bonds: 4; (4)Polar Surface Area: 48.42 Å²; (5)Index of Refraction: 1.592; (6)Molar Refractivity: 70.16 cm³; (7)Molar Volume: 207.1 cm³; (8)Polarizability: 27.81x10^-24cm³; (9)Surface Tension: 47 dyne/cm; (10)Density: 1.282 g/cm³; (11)Flash Point: 175.7 °C; (12)Enthalpy of Vaporization: 61.34 kJ/mol; (13)Boiling Point: 366.9 °C at 760 mmHg; (14)Vapour Pressure: 1.42E-05 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
If you want to store it, you should keep the container tightly sealed in dry, cool places and avoid contact with oxide. If you store and use this chemical according the rule, it will not be decomposed.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1c2cccc(OC)c2ncc1C(=O)OCC
(2)InChI: InChI=1/C13H12ClNO3/c1-3-18-13(16)9-7-15-12-8(11(9)14)5-4-6-10(12)17-2/h4-7H,3H2,1-2H3
(3)InChIKey: BBOZDELEERNECG-UHFFFAOYAQ
(4)Std. InChI: InChI=1S/C13H12ClNO3/c1-3-18-13(16)9-7-15-12-8(11(9)14)5-4-6-10(12)17-2/h4-7H,3H2,1-2H3
(5)Std. InChIKey: BBOZDELEERNECG-UHFFFAOYSA-N