Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
3-Bromo-4-phenylpyridine |
EINECS | N/A |
CAS No. | 88345-89-5 | Density | 1.426 g/cm3 |
PSA | 12.89000 | LogP | 3.51110 |
Solubility | N/A | Melting Point |
49-50 °C |
Formula | C11H8BrN | Boiling Point | 292.8 °C at 760 mmHg |
Molecular Weight | 234.095 | Flash Point | 130.9 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
4-Phenyl-3-bromopyridine;3-Bromo-4-phenylpyridine; |
Article Data | 8 |
This chemical is called 3-Bromo-4-phenylpyridine, and it can also be named as 4-Phenyl-3-bromopyridine. With the molecular formula of C11H8BrN, its molecular weight is 234.09. The CAS registry number of this chemical is 88345-89-5. Additionally, its product category is Pharmaceutical Intermediates.
Other characteristics of the 3-Bromo-4-phenylpyridine can be summarised as followings: (1)ACD/LogP: 3.41; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.41; (4)ACD/LogD (pH 7.4): 3.41; (5)ACD/BCF (pH 5.5): 230.14; (6)ACD/BCF (pH 7.4): 230.93; (7)ACD/KOC (pH 5.5): 1705.66; (8)ACD/KOC (pH 7.4): 1711.53; (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: 130.9 °C; (20)Enthalpy of Vaporization: 51.1 kJ/mol; (21)Boiling Point: 292.8 °C at 760 mmHg; (22)Vapour Pressure: 0.00314 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: Brc2c(c1ccccc1)ccnc2
2.InChI: InChI=1/C11H8BrN/c12-11-8-13-7-6-10(11)9-4-2-1-3-5-9/h1-8H
3.InChIKey: LVNPADQPUYHCOR-UHFFFAOYAX