3-(4-Bromophenyl)pyridine supplier

Name
3-(4-BROMOPHENYL)PYRIDINE
EINECS -0
CAS No. 129013-83-8
Article Data29
CAS DataBase
Density 1.426g/cm³
Solubility
Melting Point 38.0 to 42.0 °C
Formula C₁₁H₈BrN
Boiling Point 331.9 °C at 760 mmHg
Molecular Weight 234.095
Flash Point 154.5 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 3-(4-BROMOPHENYL)PYRIDINE
PSA 12.89000
LogP 3.51110

3-(4-Bromophenyl)pyridine Specification

The 3-(4-Bromophenyl)-pyridine, with CAS registry number 129013-83-8, belongs to the following product category: Pharmacetical. It has the systematic name of 3-(4-bromophenyl)pyridine. Besides this, it is also called pyridine, 3-(4-bromophenyl)-. And the chemical formula of this chemical is C₁₁H₈BrN.

Physical properties of 3-(4-Bromophenyl)-pyridine: (1)ACD/LogP: 3.56; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.5; (4)ACD/LogD (pH 7.4): 3.56; (5)ACD/BCF (pH 5.5): 260.34; (6)ACD/BCF (pH 7.4): 300.52; (7)ACD/KOC (pH 5.5): 1789.34; (8)ACD/KOC (pH 7.4): 2065.5; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 12.89 Å²; (13)Index of Refraction: 1.606; (14)Molar Refractivity: 56.62 cm³; (15)Molar Volume: 164.1 cm³; (16)Polarizability: 22.44×10^-24cm³; (17)Surface Tension: 45 dyne/cm; (18)Density: 1.426 g/cm³; (19)Flash Point: 154.5 °C; (20)Enthalpy of Vaporization: 55.18 kJ/mol; (21)Boiling Point: 331.9 °C at 760 mmHg; (22)Vapour Pressure: 0.000291 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Brc2ccc(c1cccnc1)cc2
(2)InChI: InChI=1/C11H8BrN/c12-11-5-3-9(4-6-11)10-2-1-7-13-8-10/h1-8H
(3)InChIKey: FCHUOBPHXDXZBK-UHFFFAOYAB
(4)Std. InChI: InChI=1S/C11H8BrN/c12-11-5-3-9(4-6-11)10-2-1-7-13-8-10/h1-8H
(5)Std. InChIKey: FCHUOBPHXDXZBK-UHFFFAOYSA-N

Product Name

3-(4-BROMOPHENYL)PYRIDINE

3-(4-Bromophenyl)pyridine Specification

Related Products

Hot Products