Ethyl 5-bromo-2-pyridinecarboxylate supplier

Name
5-bromo-2-pyridinecarboxylic acid ethyl ester
EINECS
CAS No. 77199-09-8
Article Data14
CAS DataBase
Density 1.501 g/cm³
Solubility
Melting Point 63-64oC
Formula C₈H₈BrNO₂
Boiling Point 303.7 °C at 760 mmHg
Molecular Weight 230.061
Flash Point 137.5 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Ethyl 5-bromo-2-pyridinecarboxylate;5-Bromo-pyridine-2-carboxylicacid ethyl ester;
PSA 39.19000
LogP 2.02080

Ethyl 5-bromo-2-pyridinecarboxylate Specification

The 2-Pyridinecarboxylicacid, 5-bromo-, ethyl ester is an organic compound with the formula C₈H₈BrNO₂. The systematic name of this chemical is Ethyl 5-bromopyridine-2-carboxylate. With the CAS registry number 77199-09-8, it is also named as 5-Bromo-2-pyridinecarboxylic acid ethyl ester. The category of the product is API intermediates. Besides, its molecular weight is 230.06.

The physical properties of 2-Pyridinecarboxylicacid, 5-bromo-, ethyl ester are: (1)ACD/LogP: 2.04; (2)ACD/LogD (pH 5.5): 2.04; (3)ACD/LogD (pH 7.4): 2.04; (4)ACD/BCF (pH 5.5): 20.92; (5)ACD/BCF (pH 7.4): 20.92; (6)ACD/KOC (pH 5.5): 306.82; (7)ACD/KOC (pH 7.4): 306.82; (8)#H bond acceptors: 3; (9)#Freely Rotating Bonds: 3; (10)Polar Surface Area: 39.19 Å²; (11)Index of Refraction: 1.544; (12)Molar Refractivity: 48.44 cm³; (13)Molar Volume: 153.2 cm³; (14)Polarizability: 19.2×10^-24 cm³; (15)Surface Tension: 44.8 dyne/cm; (16)Density: 1.501 g/cm³; (17)Flash Point: 137.5 °C; (18)Enthalpy of Vaporization: 54.4 kJ/mol; (19)Boiling Point: 303.7 °C at 760 mmHg; (20)Vapour Pressure: 0.000914 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: CCOC(=O)c1ccc(cn1)Br
(2)InChI: InChI=1/C8H8BrNO2/c1-2-12-8(11)7-4-3-6(9)5-10-7/h3-5H,2H2,1H3
(3)InChIKey: MVJPVDSRSXLJNQ-UHFFFAOYAT
(4)Std. InChI: InChI=1S/C8H8BrNO2/c1-2-12-8(11)7-4-3-6(9)5-10-7/h3-5H,2H2,1H3
(5)Std. InChIKey: MVJPVDSRSXLJNQ-UHFFFAOYSA-N

Product Name

5-bromo-2-pyridinecarboxylic acid ethyl ester

Ethyl 5-bromo-2-pyridinecarboxylate Specification

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