Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
4-Bromo-4'-(2-methylbutyl)-1,1'-biphenyl |
EINECS | N/A |
CAS No. | 62614-29-3 | Density | 1.195 g/cm3 |
PSA | 0.00000 | LogP | 5.70470 |
Solubility | N/A | Melting Point |
N/A |
Formula | C17H19Br | Boiling Point | 373 °C at 760 mmHg |
Molecular Weight | 303.24 | Flash Point | 173.5 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
4-Bromo-4'-(2-methylbutyl)-1,1'-biphenyl;(S)-4-Bromo-4'-(2-methylbutyl)-1,1'-biphenyl;1,1'-Biphenyl, 4-bromo-4'-(2-methylbutyl)-, (S)- (9CI) |
Article Data | 3 |
The 4-Bromo-4'-(2-methylbutyl)-1,1'-biphenyl with its cas register number is 62614-29-3. The Systematic name about this chemical is 4-bromo-4'-(2-methylbutyl)biphenyl.
Physical properties about 4-Bromo-4'-(2-methylbutyl)-1,1'-biphenyl are: (1)ACD/LogP: 7.28; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 7.28; (4)ACD/LogD (pH 7.4): 7.28; (5)ACD/BCF (pH 5.5): 201311.81; (6)ACD/BCF (pH 7.4): 201311.81; (7)ACD/KOC (pH 5.5): 217813.69; (8)ACD/KOC (pH 7.4): 217813.69; (9)#Freely Rotating Bonds: 4; (11)Index of Refraction: 1.559; (12)Molar Refractivity: 81.94 cm3; (13)Molar Volume: 253.6 cm3; (14)Polarizability: 32.48x10-24cm3; (15)Surface Tension: 36.7 dyne/cm; (16)Enthalpy of Vaporization: 59.58 kJ/mol; (17)Vapour Pressure: 1.99E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Brc1ccc(cc1)c2ccc(CC(C)CC)cc2
(2)InChI: InChI=1/C17H19Br/c1-3-13(2)12-14-4-6-15(7-5-14)16-8-10-17(18)11-9-16/h4-11,13H,3,12H2,1-2H3
(3)InChIKey: DHBUKCBXDUGJEY-UHFFFAOYAG