uspto-grants-1979_04 · 10.6084/m9.figshare.5104873.v1 · US04148909
查看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
- 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
Physical Description
Beige hygroscopic crystals; [Sigma-Aldrich MSDS]
GHS
GHS分类
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
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
Protective Action Criteria (PAC)
0.71 [mg/m3]
7.9 [mg/m3]
47 [mg/m3]
TOXICITY
毒理信息
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
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
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
REACTIONS
参与反应
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