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119830-47-6

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Basic Information
CAS No.: 119830-47-6
Name: 2-Pyridinecarboxylicacid,5-amino-,ethylester(9CI)
Article Data: 24
Molecular Structure:
Molecular Structure of 119830-47-6 (2-Pyridinecarboxylicacid,5-amino-,ethylester(9CI))
Formula: C8H10N2O2
Molecular Weight: 166.18
Synonyms: 5-Aminopyridine-2-carboxylicacid ethyl ester;
Density: 1.193 g/cm3
Boiling Point: 340.789 °C at 760 mmHg
Flash Point: 159.904 °C
PSA: 65.21000
LogP: 1.42170
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Specification

The 2-Pyridinecarboxylicacid, 5-amino-, ethyl ester is an organic compound with the formula C8H10N2O2. The IUPAC name of this chemical is Ethyl 5-aminopyridine-2-carboxylate. With the CAS registry number 119830-47-6, it is also named as 5-Amino-pyridine-2-carboxylic acid ethyl ester. The category of the product is Glycinescaffold. Besides, its molecular weight is 166.1772.

The physical properties of 2-Pyridinecarboxylicacid, 5-amino-, ethyl ester are: (1)ACD/LogP: 0.54; (2)ACD/LogD (pH 5.5): 1; (3)ACD/LogD (pH 7.4): 1; (4)ACD/BCF (pH 5.5): 2; (5)ACD/BCF (pH 7.4): 2; (6)ACD/KOC (pH 5.5): 64; (7)ACD/KOC (pH 7.4): 64; (8)#H bond acceptors: 4; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 4; (11)Polar Surface Area: 65.21 Å2; (12)Index of Refraction: 1.559; (13)Molar Refractivity: 44.986 cm3; (14)Molar Volume: 139.337 cm3; (15)Polarizability: 17.834×10-24 cm3; (16)Surface Tension: 50.745 dyne/cm; (17)Density: 1.193 g/cm3; (18)Flash Point: 159.904 °C; (19)Enthalpy of Vaporization: 58.438 kJ/mol; (20)Boiling Point: 340.789 °C at 760 mmHg. 

You can still convert the following datas into molecular structure:
(1)SMILES: Nc1cnc(cc1)C(=O)OCC
(2)InChI: InChI=1/C8H10N2O2/c1-2-12-8(11)7-4-3-6(9)5-10-7/h3-5H,2,9H2,1H3
(3)InChIKey: JOUCUZXFDZISMW-UHFFFAOYAT
(4)Std. InChI: InChI=1S/C8H10N2O2/c1-2-12-8(11)7-4-3-6(9)5-10-7/h3-5H,2,9H2,1H3
(5)Std. InChIKey: JOUCUZXFDZISMW-UHFFFAOYSA-N