5-Bromo-2-chloro-3-methoxypyridine supplier

Name
5-BROMO-2-CHLORO-3-METHOXYPYRIDINE
EINECS
CAS No. 286947-03-3
Article Data3
CAS DataBase
Density 1.65 g/cm³
Solubility
Melting Point 68-72°C
Formula C₆H₅BrClNO
Boiling Point 245.617 °C at 760 mmHg
Molecular Weight 222.469
Flash Point 102.346 °C
Transport Information
Appearance
Safety 26-39-45
Risk Codes 22-41-25
Molecular Structure
Hazard Symbols Xn,T
Synonyms 5-Bromo-2-chloro-3-methoxypyridine;2-Chloro-3-methoxy-5-bromopyridine;
PSA 22.12000
LogP 2.50610

5-Bromo-2-chloro-3-methoxypyridine Specification

The IUPAC name of 5-Bromo-2-chloro-3-methoxypyridine is 5-bromo-2-chloro-3-methoxypyridine. With the CAS registry number 286947-03-3, it is also named as Pyridine,5-bromo-2-chloro-3-methoxy-. In addition, its molecular formula is C₆H₅BrClNO and its molecular weight is 222.47.

The other characteristics of 5-Bromo-2-chloro-3-methoxypyridine can be summarized as: (1)ACD/LogP: 2.42; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3; (4)ACD/LogD (pH 7.4): 3; (5)ACD/BCF (pH 5.5): 76; (6)ACD/BCF (pH 7.4): 76; (7)ACD/KOC (pH 5.5): 775; (8)ACD/KOC (pH 7.4): 775; (9)H bond acceptors: 2; (10)H bond donors: 0; (11)Freely Rotating Bonds: 1; (12)Polar Surface Area: 22.12 Å²; (13)Index of Refraction: 1.56; (14)Molar Refractivity: 43.608 cm³; (15)Molar Volume: 134.795 cm³; (16)Polarizability: 17.287×10^-24cm³; (17)Surface Tension: 42.642 dyne/cm; (18)Density: 1.65 g/cm³; (19)Flash Point: 102.346 °C; (20)Enthalpy of Vaporization: 46.316 kJ/mol; (21)Boiling Point: 245.617 °C at 760 mmHg; (22)Vapour Pressure: 0.045 mmHg at 25 °C.

People can use the following data to convert to the molecule structure.
(1)SMILES:COc1cc(Br)cnc1Cl
(2)InChI:InChI=1/C6H5BrClNO/c1-10-5-2-4(7)3-9-6(5)8/h2-3H,1H3
(3)InChIKey:GFJMOZYIDADKLJ-UHFFFAOYAU
(4)Std. InChI:InChI=1S/C6H5BrClNO/c1-10-5-2-4(7)3-9-6(5)8/h2-3H,1H3
(5)Std. InChIKey:GFJMOZYIDADKLJ-UHFFFAOYSA-N

Product Name

5-BROMO-2-CHLORO-3-METHOXYPYRIDINE

5-Bromo-2-chloro-3-methoxypyridine Specification

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