CAS No.64064-56-8,4-Chloropyridine-2-carboxylic acid ethyl ester Suppliers

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Basic Information

Molecular Structure:
CAS No.:	64064-56-8
Name:	4-Chloropyridine-2-carboxylic acid ethyl ester
Article Data:	17

Formula:	C₈H₈ClNO₂
Molecular Weight:	185.61
Synonyms:	Picolinicacid, 4-chloro-, ethyl ester (7CI);4-Chloropyridine-2-carboxylic acid ethylester;Ethyl 4-chloro-2-pyridinecarboxylate;Ethyl 4-chloropicolinate;
EINECS:	-0
Density:	1.246 g/cm³
Boiling Point:	278.561 °C at 760 mmHg
Flash Point:	122.27 °C
PSA:	39.19000
LogP:	1.91170

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Specification

The 2-Pyridinecarboxylicacid, 4-chloro-, ethyl ester, with the CAS registry number 64064-56-8, is also known as Ethyl 4-chloropyridine-2-carboxylate. This chemical's molecular formula is C₈H₈ClNO₂ and molecular weight is 185.6076. Its systematic name is called ethyl 4-chloropyridine-2-carboxylate.

Physical properties of 2-Pyridinecarboxylicacid, 4-chloro-, ethyl ester: (1)ACD/LogP: 1.85; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.852; (4)ACD/LogD (pH 7.4): 1.852; (5)ACD/BCF (pH 5.5): 15.049; (6)ACD/BCF (pH 7.4): 15.049; (7)ACD/KOC (pH 5.5): 242.37; (8)ACD/KOC (pH 7.4): 242.371; (9)#H bond acceptors: 3; (10)#Freely Rotating Bonds: 3; (11)Index of Refraction: 1.525; (12)Molar Refractivity: 45.645 cm³; (13)Molar Volume: 149.007 cm³; (14)Surface Tension: 43.16 dyne/cm; (15)Density: 1.246 g/cm³; (16)Flash Point: 122.27 °C; (17)Enthalpy of Vaporization: 51.719 kJ/mol; (18)Boiling Point: 278.561 °C at 760 mmHg; (19)Vapour Pressure: 0.004 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CCOC(=O)c1cc(ccn1)Cl
(2)InChI: InChI=1/C8H8ClNO2/c1-2-12-8(11)7-5-6(9)3-4-10-7/h3-5H,2H2,1H3
(3)InChIKey: MXEIFGRJRCYUDJ-UHFFFAOYAG