CAS 1218-35-5 Xylometazoline Hydrochloride (HCID 5282386)

概要

See also: Xylometazoline (has active moiety).

名称と識別子

優先名称: Xylometazoline Hydrochloride
IUPAC: 2-[(4-tert-butyl-2,6-dimethylphenyl)methyl]-4,5-dihydro-1H-imidazole;hydrochloride
現地名: キシロメタゾリン塩酸塩
英語名: Xylometazoline hydrochloride
分子式: C16H25ClN2
分子量: 280.84

名称と別名

Xylometazoline hydrochloride1218-35-5Xylometazoline HClNeo-Synephrine IIOtrivin hydrochlorideDTXSID3045223NSC-757378DTXCID1025223X5S84033NZXylometazoline hydrochloride (USP)2-(4-tert-Butyl-2,6-dimethylbenzyl)-2-imidazoline monohydrochloride1H-Imidazole, 2-[[4-(1,1-dimethylethyl)-2,6-dimethylphenyl]methyl]-4,5-dihydro-, monohydrochloride

名称をさらに表示

キシロメタゾリン塩酸塩2-(4-tert-ブチル-2,6-ジメチルベンジル)-2-イミダゾリン塩酸塩塩酸キシロメタゾリンXYLOMETAZOLIN HYDROCHLORIDEOlynthNovorinXyMelinTherapinBrizolinGalazolinNeo-Rinoleina

1H-Imidazole, 2-((4-(1,1-dimethylethyl)-2,6-dimethylphenyl)methyl)-4,5-dihydro-, monohydrochlorideSinosilXylomet hclNazo-mistOtrivine hay fever forRefChem:58082Metarivin Soln. 0.1%Sinosil Nasal Decongestant

データベース識別子

CAS: 1218-35-5
PubChem CID: 5282386
DTXSID: DTXSID3045223
ChEMBL: CHEMBL1256400
UNII: X5S84033NZ
EC Number: 214-936-4

物性

構造計算による物性

極性表面積: 24.4 Å²
水素結合供与体数: 2
水素結合受容体数: 1
回転可能結合数: 3
重原子数: 19
形式電荷: 0
複雑度: 302

実験および物理化学的性質

Human DrugsBreast Feeding; Lactation; Milk, Human; Adrenergic alpha-Agonists; Sympathomimetics; Nasal Decongestants

Collision Cross Section168.9 Å² [M+H]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]

物理化学的性質

融点: 131 · 131-133 C
貯蔵温度: 2 · 2-8°C
溶解性: 水、エタノール (96%)、メタノールに溶けやすい。
外見: Solid
色: クリスタル
Merck: 14 · 14,10086
主な用途: 法医学と毒物学獣医
InChI: InChI=1S/C16H24N2.ClH/c1-11-8-13(16(3,4)5)9-12(2)14(11)10-15-17-6-7-18-15;/h8-9H,6-7,10H2,1-5H3,(H,17,18);1H
InChIKey: YGWFCQYETHJKNX-UHFFFAOYSA-N
SMILES: C(C1NCCN=1)C1C(=CC(C(C)(C)C)=CC=1C)C.Cl
CAS データベース: 1218 · 1218-35-5(CAS DataBase Reference)
EPAの化学物質情報: 1 H-Imidazole, · 1H-Imidazole, 2-[[4-(1,1-dimethylethyl)-2,6-dimethylphenyl]methyl]-4,5-dihydro-, monohydrochloride (1218-35-5)

化学的性質

化学的特性Xylometazoline hydrochloride is white or almost white, crystalline powder.

安全と法規制

GHS分類

GHS Classification · 4 件

Danger

H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]

P264, P270, P301+P316, P321, P330, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 74 reports by companies from 6 notifications to the ECHA C&L Inventory.

危険有害性情報

Regulatory Information · 2 件

Chemical: 1H-Imidazole, 2-[[4-(1,1-dimethylethyl)-2,6-dimethylphenyl]methyl]-4,5-dihydro-, monohydrochloride

Xylometazoline hydrochloride: Does not have an individual approval but may be used under an appropriate group standard

Other Safety InformationIMAP assessments - 1H-Imidazole, 2-[[4-(1,1-dimethylethyl)-2,6-dimethylphenyl]methyl]-4,5-dihydro-, monohydrochloride: Environment tier I assessment

Hazard Classes and CategoriesAcute Tox. 3 (100%)

毒性情報

Effects During Pregnancy and Lactation◉ Summary of Use during Lactation

安全データ

wgk: 3
tsca: TSCA listed
rtecs: NJ2390000
ridadr: UN 2811 6.1/PG 3
毒性: LD50 orl-rat: 230 mg/kg KSRNAM 5,555,71
hs_code: 29332900
risk_code: 22-36/37/38
hazard_code: Xn,Xi
safety_code: 36-26
hazard_class: 6.1
packing_group: III
Hazard Classifications: Acute Tox. 3 Oral
ストレージクラス: 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects

化学と産業

薬理情報

MeSH Pharmacological Classification · 1 件

Drugs designed to treat inflammation of the nasal passages, generally the result of an infection (more often than not the common cold) or an allergy related condition, e.g., hay fever. The inflammation involves swelling of the mucous membrane that lines the nasal passages and results in inordinate mucus production. The primary class of nasal decongestants are vasoconstrictor agents. (From PharmAssist, The Family Guide to Health and Medicine, 1993)

用途と製造

General Manufacturing Information1H-Imidazole, 2-[[4-(1,1-dimethylethyl)-2,6-dimethylphenyl]methyl]-4,5-dihydro-, hydrochloride (1:1): ACTIVE

応用分野

使用Xylometazoline hydrochloride may be used as a reference standard in determining the xylometazoline hydrochloride content in samples of nasal drops using high performance liquid chromatography (HPLC).

一般的な説明Xylometazoline hydrochloride is a derivative of imidazole, and a representative of the class of α1 agonists. It is commonly used in nasal decongestants, which works on the principle of constricting the blood vessels in the mucous membranes.

上流・下流製品情報

上流原料

塩酸エチレンジアミン (無水)

サプライヤー100 社

北京华美互利生物化工010-56205725 · [email protected]

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

郑州阿尔法化工有限公司+86-18530059196 · [email protected]

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

广州隽沐生物科技股份有限公司020-36607679; 13502246435 · [email protected]

化合物ノート

読み込み中…

キシロメタゾリン塩酸塩

基本情報

概要