Products Categories
| CAS No.: | 14984-68-0 |
|---|---|
| Name: | Cloperastine hydrochloride |
| Article Data: | 1 |
| Molecular Structure: | |
|
|
|
| Formula: | C20H24ClNO.HCl |
| Molecular Weight: | 366.331 |
| Synonyms: | Nitossil;Novotusil;Seki;p-Chlorobenzhydryl 2-(1-piperidyl)ethyl ether hydrochloride;Piperidine,1-[2-[(4-chlorophenyl)phenylmethoxy]ethyl]-, hydrochloride (9CI);Piperidine,1-[2-[(p-chloro-a-phenylbenzyl)oxy]ethyl]-,hydrochloride (6CI,8CI);HT 11;Hustazol; |
| EINECS: | 239-067-8 |
| Melting Point: | 147.9° |
| Boiling Point: | 423.9 °C at 760 mmHg |
| Flash Point: | 210.2 °C |
| Hazard Symbols: |
 Xn
|
| Risk Codes: | 22 |
| Safety: | 36 |
| PSA: | 12.47000 |
| LogP: | 5.67180 |
- 483366-12-7(2S,4R)-1-Boc-2-cyano-4-hydroxypyrrolidine
- 173606-50-3BOC-10-AMINODECANOIC ACID
- 361456-36-2METHYL (R)-(+)-ISOCYANATO-3-PHENYLPROPI&
- 5156-58-1N-(1-Benzyl-4-pipperidinyl)-N-phenylpropanamide HCl
- 81281-59-67-Benzylideneaminotheophylline
- 50288-62-5threo-Phenyl-2-piperidyl acetamide
- 82993-81-5D-threo-Ritalinic acid hydrochloride
- 47087-37-6Z-D-Glu-OMe
- 73441-42-6METHYL-5-CHLORO-2,2-DIMETHYLVALERATE
- 211914-50-0N-[[2-[[[4-(Aminoiminomethyl)phenyl]amino]methyl]-1-methyl-1H-benzimidazol-5-yl]carbonyl]-N-(2-pyridinyl)-beta-alanine ethyl ester hydrochloride
- 14984-68-0
Cloperastine hydrochloride
| Conditions | Yield |
|---|---|
| With water; oxygen; sodium hydroxide In tetrahydrofuran at 60℃; under 760.051 Torr; for 24h; Green chemistry; regioselective reaction; | 93% |
What can I do for you?
Get Best Price
Specification
The Cloperastine hydrochloride is an organic compound with the formula C20H24ClNO.HCl. The IUPAC name of this chemical is 1-[2-[(4-chlorophenyl)-phenylmethoxy]ethyl]piperidine hydrochloride. With the CAS registry number 14984-68-0, it is also named as 2-Piperidinoethyl p-chlorobenzhydryl ether hydrochloride. The classification code is Drug / Therapeutic Agent.
The other characteristics of Cloperastine hydrochloride can be summarized as: (1)ACD/LogP: 5.16; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 2.25; (4)ACD/LogD (pH 7.4): 3.69; (5)ACD/BCF (pH 5.5): 5.99; (6)ACD/BCF (pH 7.4): 164.96; (7)ACD/KOC (pH 5.5): 18.63; (8)ACD/KOC (pH 7.4): 513; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 6; (12)Flash Point: 210.2 °C; (13)Enthalpy of Vaporization: 67.83 kJ/mol; (14)Boiling Point: 423.9 °C at 760 mmHg; (15)Vapour Pressure: 2.15E-07 mmHg at 25°C; (16)Rotatable Bond Count: 6; (17)Exact Mass: 365.13132; (18)MonoIsotopic Mass: 365.13132; (19)Topological Polar Surface Area: 12.5; (20)Heavy Atom Count: 24; (21)Complexity: 318.
When you are using this chemical, please be cautious about it as the following:
It is harmful if swallowed. If you want to contact this product, you must wear suitable protective clothing.
People can use the following data to convert to the molecule structure.
1. SMILES:Cl.Clc1ccc(cc1)C(OCCN2CCCCC2)c3ccccc3
2. InChI:InChI=1/C20H24ClNO.ClH/c21-19-11-9-18(10-12-19)20(17-7-3-1-4-8-17)23-16-15-22-13-5-2-6-14-22;/h1,3-4,7-12,20H,2,5-6,13-16H2;1H
3. InChIKey:UNPLRYRWJLTVAE-UHFFFAOYAW
The following are the toxicity data which has been tested.
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | intraperitoneal | 96mg/kg (96mg/kg) | Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 7, Pg. 1496, 1965. | |
| mouse | LD50 | oral | 553mg/kg (553mg/kg) | Bollettino Chimico Farmaceutico. Vol. 122, Pg. 384, 1983. | |
| mouse | LD50 | subcutaneous | 439mg/kg (439mg/kg) | Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 7, Pg. 1496, 1965. | |
| rat | LD50 | intraperitoneal | 150mg/kg (150mg/kg) | Bollettino Chimico Farmaceutico. Vol. 122, Pg. 384, 1983. | |
| rat | LD50 | oral | 1986mg/kg (1986mg/kg) | Bollettino Chimico Farmaceutico. Vol. 122, Pg. 384, 1983. |