Products Categories
| CAS No.: | 69756-53-2 |
|---|---|
| Name: | HALOFANTRINE |
| Molecular Structure: | |
|
|
|
| Formula: | C26H30Cl2F3NO |
| Molecular Weight: | 500.432 |
| Synonyms: | 3-(dibutylamino)-1-[1,3-dichloro-6-(trifluoromethyl)phenanthren-9-yl]propan-1-ol;Halfan;Halofantrine;dl-WR 171669;1-(1,3-Dichloro-6-trifluoromethyl-9-phenanthryl)-3-di(n-butyl)aminopropanol;3-(Dibutylamino)-1-(1,3-dichlor-6-(trifluormethyl)-9-phenanthryl)propanol;1,3-Dichloro-a-[2-(dibutylamino)ethyl]-6-(trifluoromethyl)-9-phenanthrenemethanol;9-phenanthrenemethanol, 1,3-dichloro-a-[2-(dibutylamino)ethyl]-6-(trifluoromethyl)-;(1S)-3-(dibutylamino)-1-[1,3-dichloro-6-(trifluoromethyl)phenanthren-9-yl]propan-1-ol; |
| EINECS: | 274-104-1 |
| Density: | 1.244 g/cm3 |
| Melting Point: | 136-138oC |
| Boiling Point: | 596.2 °C at 760 mmHg |
| Flash Point: | 314.4 °C |
| Solubility: | 0.59mg/L(37 oC) |
| Appearance: | White solid |
| PSA: | 23.47000 |
| LogP: | 8.64430 |
- 81281-59-67-Benzylideneaminotheophylline
- 82993-81-5D-threo-Ritalinic acid hydrochloride
- 73441-42-6METHYL-5-CHLORO-2,2-DIMETHYLVALERATE
- 852475-26-4MC1568
- 958254-66-51H-Imidazo[4,5-b]pyridine-2-carboxaldehyde, 1-methyl-, hydrochloride
- 99170-93-1N-Methyl-2-oxazolamine
- 717878-06-31-(4-fluorophenyl)-4-nitro-1H-imidazole
- 914458-26-7[5-(2-fluorophenyl)-1-pentyl-1H-pyrrol-3-yl]-1-naphthalenyl-Methanone
- 894852-01-87-BROMO-2,2-DIMETHYL-2H-PYRIDO[3,2-B][1,4]OXAZIN-3(4H)-ONE
- 71825-51-92-methyl-2-(4-nitrophenyl)propanenitrile
What can I do for you?
Get Best Price
Specification
The Halofantrine HCl, with the CAS registry number 69756-53-2 and EINECS registry number 274-104-1, has the systematic name of 3-(dibutylamino)-1-[1,3-dichloro-6-(trifluoromethyl)phenanthren-9-yl]propan-1-ol. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C26H30Cl2F3NO.
The characteristics of Halofantrine HCl are as followings: (1)ACD/LogP: 8.72; (2)# of Rule of 5 Violations: 2; (3)ACD/LogD (pH 5.5): 5.68; (4)ACD/LogD (pH 7.4): 6.74; (5)ACD/BCF (pH 5.5): 2278.49; (6)ACD/BCF (pH 7.4): 26275.09; (7)ACD/KOC (pH 5.5): 1207.63; (8)ACD/KOC (pH 7.4): 13926.19; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 11; (12)Polar Surface Area: 12.47 Å2; (13)Index of Refraction: 1.577; (14)Molar Refractivity: 133.21 cm3; (15)Molar Volume: 401.9 cm3; (16)Polarizability: 52.8×10-24cm3; (17)Surface Tension: 41.4 dyne/cm; (18)Density: 1.244 g/cm3; (19)Flash Point: 314.4 °C; (20)Enthalpy of Vaporization: 93.42 kJ/mol; (21)Boiling Point: 596.2 °C at 760 mmHg; (22)Vapour Pressure: 4.62E-15 mmHg at 25°C.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: FC(F)(F)c3ccc2c(cc1c(Cl)cc(Cl)cc1c2c3)C(O)CCN(CCCC)CCCC
(2)InChI: InChI=1/C26H30Cl2F3NO/c1-3-5-10-32(11-6-4-2)12-9-25(33)23-16-22-21(14-18(27)15-24(22)28)20-13-17(26(29,30)31)7-8-19(20)23/h7-8,13-16,25,33H,3-6,9-12H2,1-2H3
(3)InChIKey: FOHHNHSLJDZUGQ-UHFFFAOYAC