N,N-Dimethylaminoethyl chloride hydrochloride
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基本情報
- CAS
4584-46-7- 標準SMILES
CN(C)CCCl.Cl- InChIKey
LQLJZSJKRYTKTP-UHFFFAOYSA-N- 分子式
- C4H11Cl2N
- 平均分子量
- 144.04 g/mol
- 単同位体質量
- 143.0268547
名称と識別子
- 優先名称
- N,N-Dimethylaminoethyl chloride hydrochloride
- IUPAC
- 2-chloro-N,N-dimethylethanamine;hydrochloride
名称と別名
4584-46-72-Chloro-N,N-dimethylethylamine hydrochloride(2-Chloroethyl)dimethylamine hydrochloride2-(Dimethylamino)ethyl chloride hydrochlorideDimethylaminoethyl chloride hydrochlorideN,N-Dimethylaminoethyl chloride hydrochlorideN,N-Dimethyl-2-chloroethylamine hydrochlorideDTXSID70521092-Dimethylaminochloroethane hydrochlorideHE7Z9G0YMAN-(2-Chloroethyl)-N,N-dimethylammonium chloridebeta-CHLOROETHYLDIMETHYLAMINE HCl
名称をさらに表示
NSC-111230N,N-Dimethyl-N-(2-chloroethyl)amine hydrochloride2-Chloroethyl dimethyl ammonium chlorideChloro(dimethylamino)ethane hydrochlorideDimethyl(2-chloroethyl)amine hydrochlorideDTXCID9030678(2-Chloroethyl)dimethylamine monohydrochloride2-Chloroethyldimethylammonium chloride
データベース識別子
- CAS
4584-46-7- PubChem CID
- 11636816
- DTXSID
DTXSID7052109- ChEMBL
CHEMBL3561603- ChEBI
CHEBI:78153- UNII
- HE7Z9G0YMA
- EC Number
- 224-970-1
物性
構造計算による物性補完中
- 極性表面積
- 3.2 Ų
- 水素結合供与体数
- 1
- 水素結合受容体数
- 1
- 回転可能結合数
- 2
- 重原子数
- 7
- 形式電荷
- 0
- 複雑度
- 28
実験および物理化学的性質
Physical DescriptionBeige hygroscopic crystals; [Sigma-Aldrich MSDS]
安全と法規制
安全情報は参考情報です。供給元の安全データシート（SDS）、適用法令、専門家による評価に代わるものではありません。
GHS分類
GHS Classification
Danger
H301 (69.6%): Toxic if swallowed [Danger Acute toxicity, oral]；H302 (31.6%): Harmful if swallowed [Warning Acute toxicity, oral]；H311 (74.7%): Toxic in contact with skin [Danger Acute toxicity, dermal]；H315 (69.6%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (69.6%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (67.1%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]；H341 (30.4%): Suspected of causing genetic defects [Warning Germ cell mutagenicity]；H373 (24.1%): May causes damage to organs through prolonged or repeated exposure [Warning Specific target organ toxicity, repeated exposure]；H411 (31.6%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
P203, P260, P261, P262, P264, P264+P265, P270, P271, P273, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P318, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 79 reports by companies from 22 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.
危険有害性情報
Regulatory Information
Status: Active Update: 19-06-2013 https://echa.europa.eu/registration-dossier/-/registered-dossier/8275；Status: Active Update: 31-05-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/12032
2-Chloroethyldimethylammonium chloride: Does not have an individual approval but may be used under an appropriate group standard
Hazards Summary
A moderate skin and eye irritant; Causes somnolence, ataxia, and tremor in oral lethal-dose studies of rats; Causes diffuse hepatitis in 7-day intermittent oral studies of rats; [RTECS] A skin and strong eye irritant; Toxic by ingestion and skin absorption; [Sigma-Aldrich MSDS] See 1-Chloro-2-(diethylamine)ethane hydrochloride.
化学と産業
用途と製造
UsesUsed as an intermediate in chemical manufacture; [ExPub: ECHA REACH Registrations]
General Manufacturing InformationEthanamine, 2-chloro-N,N-dimethyl-, hydrochloride (1:1): ACTIVE
関連反応
449 件
化合物ノート
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