Pyridine,4-bromo-2-chloro-3-methyl- supplier

Name
2-Chloro-4-Bromo-3-Picoline
EINECS
CAS No. 128071-86-3
Article Data3
CAS DataBase
Density 1.625g/cm³
Solubility
Melting Point
Formula C₆H₅BrClN
Boiling Point 249.746 °C at 760 mmHg
Molecular Weight 206.469
Flash Point 104.843 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms bromo-4 chloro-2 methyl-3 pyridine;4-Bromo-2-chloro-3-picoline;2-CHLORO-4-BROMO-3-PICOLINE;4-BROMO-2-CHLOROPICOLINE;
PSA 12.89000
LogP 2.80590

Pyridine,4-bromo-2-chloro-3-methyl- Specification

The Pyridine,4-bromo-2-chloro-3-methyl-, with CAS registry number 128071-86-3, belongs to the following product category: Pyridine. It has the systematic name of 4-bromo-2-chloro-3-methyl-pyridine. Besides this, it is also called 2-Chloro-4-Bromo-3-Picoline. And the chemical formula of this chemical is C₆H₅BrClN.

Physical properties of Pyridine,4-bromo-2-chloro-3-methyl-: (1)ACD/LogP: 2.89; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.888; (4)ACD/LogD (pH 7.4): 2.888; (5)ACD/BCF (pH 5.5): 92.249; (6)ACD/BCF (pH 7.4): 92.251; (7)ACD/KOC (pH 5.5): 887.417; (8)ACD/KOC (pH 7.4): 887.436; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 12.89 Å²; (13)Index of Refraction: 1.571; (14)Molar Refractivity: 41.754 cm³; (15)Molar Volume: 127.068 cm³; (16)Polarizability: 16.553×10^-24cm³; (17)Surface Tension: 43.022 dyne/cm; (18)Density: 1.625 g/cm³; (19)Flash Point: 104.843 °C; (20)Enthalpy of Vaporization: 46.729 kJ/mol; (21)Boiling Point: 249.746 °C at 760 mmHg; (22)Vapour Pressure: 0.036 mmHg at 25°C.、

You can still convert the following datas into molecular structure:
(1)SMILES: Cc1c(ccnc1Cl)Br
(2)InChI: InChI=1/C6H5BrClN/c1-4-5(7)2-3-9-6(4)8/h2-3H,1H3
(3)InChIKey: XOHGSWUURFCOIL-UHFFFAOYAM
(4)Std. InChI: InChI=1S/C6H5BrClN/c1-4-5(7)2-3-9-6(4)8/h2-3H,1H3
(5)Std. InChIKey: XOHGSWUURFCOIL-UHFFFAOYSA-N

Product Name

2-Chloro-4-Bromo-3-Picoline

Pyridine,4-bromo-2-chloro-3-methyl- Specification

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