Ethyl 4-ethoxy-2-pyridinecarboxylate supplier

Name
4-Ethoxy-2-pyridinecarboxylic acid ethyl ester
EINECS
CAS No. 71777-70-3
Article Data7
CAS DataBase
Density 1.099g/cm³
Solubility
Melting Point
Formula C₁₀H₁₃NO₃
Boiling Point 309 °C at 760 mmHg
Molecular Weight 195.218
Flash Point 140.7 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Picolinicacid, 4-ethoxy-, ethyl ester (7CI);Ethyl 4-ethoxypicolinate;
PSA 48.42000
LogP 1.65700

Ethyl 4-ethoxy-2-pyridinecarboxylate Specification

The Ethyl 4-ethoxy-2-pyridinecarboxylate with cas registry number of 71777-70-3, has the systematic name of 2-pyridinecarboxylic acid, 4-ethoxy-, ethyl ester. And it is also named 2-pyridinecarboxylic acid, 4-ethoxy-, ethyl ester.

Physical properties about this chemical are: (1)ACD/LogP: 1.81; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.81; (4)ACD/LogD (pH 7.4): 1.81; (5)ACD/BCF (pH 5.5): 13.88; (6)ACD/BCF (pH 7.4): 14.03; (7)ACD/KOC (pH 5.5): 228; (8)ACD/KOC (pH 7.4): 230.45; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 48.42 Å²; (13)Index of Refraction: 1.498; (14)Molar Refractivity: 52.06 cm³; (15)Molar Volume: 177.5 cm³; (16)Polarizability: 20.63×10^-24cm³; (17)Surface Tension: 38.5 dyne/cm; (18)Enthalpy of Vaporization: 54.97 kJ/mol; (19)Vapour Pressure: 0.000657 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CCOc1ccnc(c1)C(=O)OCC;
(2)InChI: InChI=1/C10H13NO3/c1-3-13-8-5-6-11-9(7-8)10(12)14-4-2/h5-7H,3-4H2,1-2H3;
(3)InChIKey: LJXADWCGSBYCDC-UHFFFAOYAJ;
(4)Std. InChI: InChI=1S/C10H13NO3/c1-3-13-8-5-6-11-9(7-8)10(12)14-4-2/h5-7H,3-4H2,1-2H3;
(5)Std. InChIKey: LJXADWCGSBYCDC-UHFFFAOYSA-N

Product Name

4-Ethoxy-2-pyridinecarboxylic acid ethyl ester

Ethyl 4-ethoxy-2-pyridinecarboxylate Specification

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