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| Name |
Benzenemethanol,2-[4-[bis(4-fluorophenyl)methyl]-1-piperazinyl]- |
EINECS | 604-604-1 |
| CAS No. | 914349-61-4 | Density | 1.243g/cm3 |
| PSA | 26.71000 | LogP | 4.37160 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C24H24F2N2O | Boiling Point | 517.5 °C at 760 mmHg |
| Molecular Weight | 394.457 | Flash Point | 266.8 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
(2-{4-[Bis(4-fluorophenyl)methyl]piperazin-1-yl}phenyl)methanol; |
Benzenemethanol,2-[4-[bis(4-fluorophenyl)methyl]-1-piperazinyl]- Specification
The Benzenemethanol,2-[4-[bis(4-fluorophenyl)methyl]-1-piperazinyl]-, with CAS registry number 914349-61-4, has the systematic name of [2-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]phenyl]methanol. And this chemical formula of this chemical is C24H24F2N2O.
Physical properties of Benzenemethanol,2-[4-[bis(4-fluorophenyl)methyl]-1-piperazinyl]-: (1)ACD/LogP: 3.67; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3; (4)ACD/LogD (pH 7.4): 3.65; (5)#H bond acceptors: 3; (6)#H bond donors: 1; (7)#Freely Rotating Bonds: 6; (8)Polar Surface Area: 26.71 Å2; (9)Index of Refraction: 1.61; (10)Molar Refractivity: 110.03 cm3; (11)Molar Volume: 317.1 cm3; (12)Polarizability: 43.61×10-24cm3; (13)Surface Tension: 49.8 dyne/cm; (14)Enthalpy of Vaporization: 83.15 kJ/mol; (15)Vapour Pressure: 1.55E-11 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: c1ccc(c(c1)CO)N2CCN(CC2)C(c3ccc(cc3)F)c4ccc(cc4)
(2)InChI: InChI=1/C24H24F2N2O/c25-21-9-5-18(6-10-21)24(19-7-11-22(26)12-8-19)28-15-13-27(14-16-28)23-4-2-1-3-20(23)17-29/h1-12,24,29H,13-17H2
(3)InChIKey: JSFGZPUFCTXDJY-UHFFFAOYAO
(4)Std. InChI: InChI=1S/C24H24F2N2O/c25-21-9-5-18(6-10-21)24(19-7-11-22(26)12-8-19)28-15-13-27(14-16-28)23-4-2-1-3-20(23)17-29/h1-12,24,29H,13-17H2
(5)Std. InChIKey: JSFGZPUFCTXDJY-UHFFFAOYSA-N
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