Product Name

  • Name

    ETHYL 5-CHLOROPYRIDINE-2-CARBOXYLATE

  • EINECS
  • CAS No. 128072-93-5
  • Article Data10
  • CAS DataBase
  • Density 1.246 g/cm3
  • Solubility
  • Melting Point 47-50 °C
  • Formula C8H8ClNO2
  • Boiling Point 263.441 °C at 760 mmHg
  • Molecular Weight 185.61
  • Flash Point 113.125 °C
  • Transport Information
  • Appearance white crystalline power
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 128072-93-5 (ETHYL 5-CHLOROPYRIDINE-2-CARBOXYLATE)
  • Hazard Symbols
  • Synonyms 5-Chloropyridine-2-carboxylic acid ethyl ester;5-Chloropyridine)-2-carboxylic acid ethyl ester, 98+%;Ethyl 5-chloropyridine-2-carboxylate;
  • PSA 39.19000
  • LogP 1.91170

Ethyl 5-chloro-2-pyridinecarboxylate Specification

The CAS register number of Ethyl 5-chloro-2-pyridinecarboxylate is 128072-93-5. It also can be called as 5-Chloropyridine-2-carboxylic acid ethyl ester and the systematic name about this chemical is ethyl 5-chloropyridine-2-carboxylate. The molecular formula about this chemical is C8H8ClNO2 and the molecular weight is 185.61.

Physical properties about Ethyl 5-chloro-2-pyridinecarboxylate are: (1)ACD/LogP: 1.59; (2)ACD/LogD (pH 5.5): 2; (3)ACD/LogD (pH 7.4): 2; (4)ACD/BCF (pH 5.5): 15; (5)ACD/BCF (pH 7.4): 15; (6)ACD/KOC (pH 5.5): 241; (7)ACD/KOC (pH 7.4): 241; (8)#H bond acceptors: 3; (9)#Freely Rotating Bonds: 3; (10)Polar Surface Area: 39.19 Å2; (11)Index of Refraction: 1.525; (12)Molar Refractivity: 45.645 cm3; (13)Molar Volume: 149.007 cm3; (14)Polarizability: 18.095x10-24cm3; (15)Surface Tension: 43.16 dyne/cm; (16)Density: 1.246 g/cm3; (17)Flash Point: 113.125 °C; (18)Enthalpy of Vaporization: 50.127 kJ/mol; (19)Boiling Point: 263.441 °C at 760 mmHg; (20)Vapour Pressure: 0.01 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1cnc(cc1)C(=O)OCC
(2)InChI: InChI=1/C8H8ClNO2/c1-2-12-8(11)7-4-3-6(9)5-10-7/h3-5H,2H2,1H3
(3)InChIKey: BEBBWTPLBRZIOF-UHFFFAOYAL
(4)Std. InChI: InChI=1S/C8H8ClNO2/c1-2-12-8(11)7-4-3-6(9)5-10-7/h3-5H,2H2,1H3
(5)Std. InChIKey: BEBBWTPLBRZIOF-UHFFFAOYSA-N

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