结构:CN(C)CCCl.Cl
HCID11636816

N,N-Dimethylaminoethyl chloride hydrochloride

2-chloro-N,N-dimethylethanamine;hydrochloride

C4H11Cl2N144.04 g/molCAS 4584-46-7

IDENTITY

结构与身份

标准 SMILES
CN(C)CCCl.Cl
InChIKey
LQLJZSJKRYTKTP-UHFFFAOYSA-N
分子式
C4H11Cl2N
平均分子量
144.04 g/mol
单同位素质量
143.0268547

COMPUTED

结构计算性质

已同步
极性表面积
3.2 Ų
氢键供体
1
氢键受体
1
可旋转键
2
重原子
7
形式电荷
0
复杂度
28

PROPERTIES

实验与物化性质

来源:PubChem
Physical Description

Beige hygroscopic crystals; [Sigma-Aldrich MSDS]

GHS

GHS 分类

来源:PubChem
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.

HAZARDS

危害信息

来源:PubChem
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.

Hazard Classes and Categories

Acute Tox. 3 (69.6%);Acute Tox. 4 (31.6%);Acute Tox. 3 (74.7%);Skin Irrit. 2 (69.6%);Eye Irrit. 2 (69.6%);STOT SE 3 (67.1%);Muta. 2 (30.4%);STOT RE 2 (24.1%);Aquatic Chronic 2 (31.6%)

SAFETY

安全与防护

来源:PubChem
Protective Action Criteria (PAC)

0.71 [mg/m3]

7.9 [mg/m3]

47 [mg/m3]

TOXICITY

毒理信息

来源:PubChem
Adverse Effects

Occupational hepatotoxin - Secondary hepatotoxins: the potential for toxic effect in the occupational setting is based on cases of poisoning by human ingestion or animal experimentation.

REGULATORY

法规信息

来源:PubChem
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

USES

用途与制造

来源:PubChem
Uses

Used as an intermediate in chemical manufacture; [ExPub: ECHA REACH Registrations]

General Manufacturing Information

Ethanamine, 2-chloro-N,N-dimethyl-, hydrochloride (1:1): ACTIVE

ALIASES

名称与别名

148
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 HClNSC-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

REACTIONS

参与反应

449