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| CAS No.: | 69142-64-9 |
|---|---|
| Name: | 6-Aminopyridine-2-carboxylic acid ethyl ester |
| Article Data: | 18 |
| Molecular Structure: | |
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| Formula: | C8H10N2O2 |
| Molecular Weight: | 166.18 |
| Synonyms: | 2-Pyridinecarboxylicacid,6-amino-;Ethyl 6-aminopicolinate; |
| Density: | 1.193 g/cm3 |
| Melting Point: | 56-58℃ |
| Boiling Point: | 329.602 °C at 760 mmHg |
| Flash Point: | 153.138 °C |
| PSA: | 65.21000 |
| LogP: | 1.42170 |
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- Total:34 Page 1 of 1 1
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Specification
The 6-Aminopyridine-2-carboxylic acid ethyl ester, with the CAS registry number 69142-64-9, is also known as 2-Pyridinecarboxylicacid,6-amino- and Ethyl 6-aminopicolinate. It belongs to the product categories of Glycinescaffold; Pharmacetical. This chemical's molecular formula is C8H10N2O2 and molecular weight is 166.1772. What's more, its systematic name is called Ethyl 6-aminopyridine-2-carboxylate.
Physical properties about 6-Aminopyridine-2-carboxylic acid ethyl ester are: (1)ACD/LogP: 0.80; (2)#of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 3; (6)ACD/BCF (pH 7.4): 4; (7)ACD/KOC (pH 5.5): 83; (8)ACD/KOC (pH 7.4): 86; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 65.21 Å2; (13)Index of Refraction: 1.559; (14)Molar Refractivity: 44.986 cm3; (15)Molar Volume: 139.337 cm3; (16)Surface Tension: 50.745 dyne/cm; (17)Density: 1.193 g/cm3; (18)Flash Point: 153.138 °C; (19)Enthalpy of Vaporization: 57.21 kJ/mol; (20)Boiling Point: 329.602 °C at 760 mmHg; (21)Vapour Pressure: 0 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: O=C(OCC)c1nc(N)ccc1
(2) InChI: InChI=1/C8H10N2O2/c1-2-12-8(11)6-4-3-5-7(9)10-6/h3-5H,2H2,1H3,(H2,9,10)
(3) InChIKey: DTYDENRYZSEGNL-UHFFFAOYAP