Methyl 5-bromo-6-chloropyridine-3-carboxylate supplier

Name
Methyl 5-bromo-6-chloropyridine-3-carboxylate
EINECS -0
CAS No. 78686-77-8
Article Data14
CAS DataBase
Density 1.684 g/cm³
Solubility
Melting Point 75-77°C
Formula C₇H₅ Br C_l N O₂
Boiling Point 279.2 °C at 760 mmHg
Molecular Weight 250.479
Flash Point 122.7 °C
Transport Information
Appearance
Safety
Risk Codes 22
Molecular Structure
Hazard Symbols
Synonyms 5-Bromo-6-chloronicotinicacid methyl ester;Methyl 5-bromo-6-chloro-3-pyridinecarboxylate;Methyl5-bromo-6-chloronicotinate;Methyl 5-bromo-6-chloronicotinate;
PSA 39.19000
LogP 2.28410

Methyl 5-bromo-6-chloropyridine-3-carboxylate Specification

The 3-Pyridinecarboxylicacid, 5-bromo-6-chloro-, methyl ester, has its cas register number 78686-77-8. And it has other names,such as methyl 5-bromo-6-chloronicotinate; 5-bromo-6-chloronicotinic acid methyl ester; methyl 3-bromo-2-chloropyridine-5-carboxylate. Its IUPAC Name is methyl 5-bromo-6-chloropyridine-3-carboxylate.

The physical properties of this chemical are as followings: (1)ACD/LogP: 2.37; (2)ACD/LogD (pH 5.5): 2.37; (3)ACD/LogD (pH 7.4): 2.37; (4)ACD/BCF (pH 5.5): 37.11; (5)ACD/BCF (pH 7.4): 37.11; (6)ACD/KOC (pH 5.5): 462.44; (7)ACD/KOC (pH 7.4): 462.44; (8)#H bond acceptors: 3 ; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 39.19; (11)Index of Refraction: 1.568; (12)Molar Refractivity: 48.7 cm³; (13)Molar Volume: 148.6 cm³; (14)Polarizability: 19.3 ×10^-24 cm³; (15)Surface Tension: 48.6 dyne/cm; (16)Density: 1.684 g/cm³; (17)Flash Point: 122.7 °C; (18)Enthalpy of Vaporization: 51.79 kJ/mol; (19)Boiling Point: 279.2 °C at 760 mmHg; (20)Vapour Pressure: 0.00407 mmHg at 25°C.

Being a kind of irritant chemical, it may cause inflammation to the skin or other mucous membranes. So you should be very careful while dealing with it. Wear suitable protective clothing and gloves, and if any accident, go to seek for medical treatment immediately.

As to its usage, it is widely used in pharmaceutics, mainly as the medical intermediates. And its product categories are including api intermediates; pyridine; esters; pyridines.

In addition, you could obtain the molecular structure by converting the following datas:
SMILES:Brc1cc(C(=O)OC)cnc1Cl
InChI:InChI=1/C7H5BrClNO2/c1-12-7(11)4-2-5(8)6(9)10-3-4/h2-3H,1H3
InChIKey:WINGWVOUOFMOJQ-UHFFFAOYAR

Product Name

Methyl 5-bromo-6-chloropyridine-3-carboxylate

Methyl 5-bromo-6-chloropyridine-3-carboxylate Specification

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