- Homochlorcyclizine
- Homochlorcyclizine hydrochloride
- 24342-60-71H-1,4-Diazepine,1-[(4-chlorophenyl)phenylmethyl]hexahydro-
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| Name |
Homochlorcyclizine hydrochloride |
EINECS | N/A |
| CAS No. | 24342-55-0 | Density | N/A |
| PSA | 6.48000 | LogP | 4.74470 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C19H23 Cl N2 . x Cl H | Boiling Point | 403.9°C at 760 mmHg |
| Molecular Weight | 570.11 | Flash Point | 198.1°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Poison by ingestion, subcutaneous, and intravenous routes. When heated to decomposition it emits toxic fumes of NOx and HCl. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | 3 |
| Synonyms |
1H-1,4-Diazepine,1-(p-chloro-a-phenylbenzyl)hexahydro-4-methyl-,hydrochloride (7CI,8CI); 1H-1,4-Diazepine,1-[(4-chlorophenyl)phenylmethyl]hexahydro-4-methyl-, hydrochloride (9CI);Homochlorcyclizine hydrochloride; Homochlorocyclizine hydrochloride |
Homochlorcyclizine hydrochloride Chemical Properties
Product Name: Homochlorcyclizine hydrochloride (CAS NO.24342-55-0)
Molecular Formula: C19H24Cl2N2
Molecular Weight: 351.3133g/mol
Mol File: 24342-55-0.mol
Boiling point: 403.9 °C at 760 mmHg
Storage Temperature:
Flash Point: 198.1 °C
Enthalpy of Vaporization: 65.53 kJ/mol
Vapour Pressure: 9.82E-07 mmHg at 25°C
H-Bond Donor: 1
H-Bond Acceptor: 2
Structure Descriptors of Homochlorcyclizine hydrochloride (CAS NO.24342-55-0):
IUPAC Name: 1-[(4-chlorophenyl)-phenylmethyl]-4-methyl-1,4-diazepan-4-ium chloride
Canonical SMILES: C[NH+]1CCCN(CC1)C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl.[Cl-]
InChI: InChI=1S/C19H23ClN2.ClH/c1-21-12-5-13-22(15-14-21)19(16-6-3-2-4-7-16)17-8-10-18(20)11-9-17;/h2-4,6-11,19H,5,12-15H2,1H3;1H
InChIKey: BDIJPBVLZALCFW-UHFFFAOYSA-N
Homochlorcyclizine hydrochloride Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| dog | LD50 | intravenous | 20mg/kg (20mg/kg) | Drugs in Japan Vol. 6, Pg. 790, 1982. | |
| dog | LD50 | oral | > 200mg/kg (200mg/kg) | Drugs in Japan Vol. 6, Pg. 790, 1982. | |
| mouse | LD50 | intravenous | 47mg/kg (47mg/kg) | Drugs in Japan Vol. 6, Pg. 790, 1982. | |
| mouse | LD50 | oral | 390mg/kg (390mg/kg) | Drugs in Japan Vol. 6, Pg. 790, 1982. | |
| mouse | LD50 | subcutaneous | 135mg/kg (135mg/kg) | Drugs in Japan Vol. 6, Pg. 790, 1982. | |
| rabbit | LD50 | intravenous | 20mg/kg (20mg/kg) | Drugs in Japan Vol. 6, Pg. 790, 1982. | |
| rat | LD50 | intravenous | 36mg/kg (36mg/kg) | Drugs in Japan Vol. 6, Pg. 790, 1982. | |
| rat | LD50 | oral | 490mg/kg (490mg/kg) | Drugs in Japan Vol. 6, Pg. 790, 1982. |
Homochlorcyclizine hydrochloride Safety Profile
Poison by ingestion, subcutaneous, and intravenous routes. When heated to decomposition it emits toxic fumes of NOx and HCl.
Homochlorcyclizine hydrochloride Specification
Homochlorcyclizine hydrochloride , its CAS NO. is 24342-55-0, the synonyms are 1-(p-Chloro-alpha-phenylbenzyl)hexahydro-4-methyl-1H-1,4-diazepine hydrochloride ; Homochlorcyclizine HCl ; 1H-1,4-Diazepine, 1-((4-chlorophenyl)phenylmethyl)hexahydro-4-methyl-, hydrochloride (9CI) ; 1H-1,4-Diazepine, 1-(p-chloro-alpha-phenylbenzyl)hexahydro-
4-methyl-, hydrochloride .
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