Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
Ethyl 4-ethoxy-2-pyridinecarboxylate |
EINECS | N/A |
CAS No. | 71777-70-3 | Density | 1.099g/cm3 |
PSA | 48.42000 | LogP | 1.65700 |
Solubility | N/A | Melting Point |
N/A |
Formula | C10H13NO3 | Boiling Point | 309 °C at 760 mmHg |
Molecular Weight | 195.218 | Flash Point | 140.7 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
Picolinicacid, 4-ethoxy-, ethyl ester (7CI);Ethyl 4-ethoxypicolinate; |
Article Data | 7 |
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