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HCID 91513作成日:2026年10月24日

Hydroxyzine Hydrochloride

Hydroxyzine Impurity 11 Dihydrochloride ((-)-Hydroxyzine Dihydrochloride)

https://huagongshe.com/ja/chemical/91513

Hydroxyzine Hydrochloride の分子構造式

識別子と物理属性

CAS No.163837-37-4
分子式C21H29Cl3N2O2
平均分子量447.8 g/mol
単同位体質量446.129461 g/mol
SMILESCl.Cl.OCCOCCN1CCN(C(c2ccccc2)c2ccc(Cl)cc2)CC1
InChIKeyANOMHKZSQFYSBR-UHFFFAOYSA-N
PubChem CID91513
ChEMBLCHEMBL3186993
EC No.218-586-3
DTXSIDDTXSID2040737

化学・物理的性質

極性表面積35.9
水素結合供与体数3
水素結合受容体数4
回転可能結合数8
重原子数28
形式電荷0
複雑度376

安全性と法規制

GHS 分類DangerH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]H314 (11.9%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]H315 (59.7%): Causes skin irritation [Warning Skin corrosion/irritation]H317 (23.9%): May cause an allergic skin reaction [Warning Sensitization, Skin]H319 (59.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H335 (61.2%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory tract irritation]H360 (23.9%): May damage fertility or the unborn child [Danger Reproductive toxicity]P203, P260, P261, P264, P264+P265, P270, P271, P272, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P318, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 67 reports by companies from 13 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
規制情報Status: Active Update: 21-12-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/33066Ethanol, 2-2-4-(4-chlorophenyl)phenylmethyl-1-piperazinylethoxy-, dihydrochloride: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
その他の安全情報IMAP assessments - Ethanol, 2-[2-[4-[(4-chlorophenyl)phenylmethyl]-1-piperazinyl]ethoxy]-, dihydrochloride: Environment tier I assessmentIMAP assessments - Ethanol, 2-[2-[4-[(4-chlorophenyl)phenylmethyl]-1-piperazinyl]ethoxy]-, dihydrochloride: Human health tier I assessment
Hazard Classes and CategoriesAcute Tox. 4 (100%)Skin Corr. 1A (11.9%)Skin Irrit. 2 (59.7%)Skin Sens. 1 (23.9%)Eye Irrit. 2 (59.7%)STOT SE 3 (61.2%)Repr. 1B (23.9%)
Drug Induced Liver InjuryDrug Induced Liver Injury Rank (DILIrank 2.0)Hydroxyzine hydrochloridevNo-DILI-concernNo matchDOI:10.1016/j.drudis.2016.02.015