反应SMILES:Cl.NCCc1c[nH]c2ccc(Cl)cc12
HCID2827494

5-Chloro-1H-indole-3-ethylamine monohydrochloride

2-(5-chloro-1H-indol-3-yl)ethanamine;hydrochloride

C10H12Cl2N2231.12 g/molCAS 55747-73-4

IDENTITY

结构与身份

标准SMILES
Cl.NCCc1c[nH]c2ccc(Cl)cc12
InChIKey
PBANXRNIXGEHPZ-UHFFFAOYSA-N
分子式
C10H12Cl2N2
平均分子量
231.12 g/mol
单同位素质量
230.0377538

COMPUTED

结构计算性质

已同步
极性表面积
41.8 Ų
氢键供体
3
氢键受体
1
可旋转键
2
重原子
14
形式电荷
0
复杂度
174

GHS

GHS分类

来源:PubChem
GHS Classification

Warning

H302 (11.1%): Harmful if swallowed [Warning Acute toxicity, oral];H315 (88.9%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (88.9%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (77.8%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 9 reports by companies from 5 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
Hazard Classes and Categories

Acute Tox. 4 (11.1%);Skin Irrit. 2 (88.9%);Eye Irrit. 2 (88.9%);STOT SE 3 (77.8%)

ALIASES

名称与别名

共 44 条
EINECS 213-387-85-Chloro-1H-indole-3-ethylamine monohydrochloride1H-Indole-3-ethanamine, 5-chloro-, hydrochloride (1:1)RefChem:534328213-387-85-Chlorotryptamine Hydrochloride942-26-72-(5-chloro-1H-indol-3-yl)ethanamine hydrochloride2-(5-chloro-1H-indol-3-yl)ethanamine;hydrochloride55747-73-4MFCD000519905-Chloro-1H-indole-3-ethylamine hydrochloride1H-Indole-3-ethanamine, 5-chloro-, monohydrochloride5-Chloro-3-(2-aminoethyl)indole Hydrochloride5-Chloro-1H-indole-3-ethylamine HCl2-(5-chloro-1H-indol-3-yl)ethan-1-amine hydrochloride5-Chlorotryptamine HCl5-chlorotryptamine, hclEINECS 259-789-7BIM-0013443.P001

REACTIONS

参与反应

231
HRID58526

uspto-grants-2016_09

作为反应物
HRID 58526 方程式

uspto-grants-2016_09 · 10.6084/m9.figshare.5104873.v1 · US09434722B2

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HRID58557

uspto-grants-2016_09

作为反应物
HRID 58557 方程式

uspto-grants-2016_09 · 10.6084/m9.figshare.5104873.v1 · US09434722B2

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HRID58565

uspto-grants-2016_09

作为反应物
HRID 58565 方程式

uspto-grants-2016_09 · 10.6084/m9.figshare.5104873.v1 · US09434722B2

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HRID58566

uspto-grants-2016_09

作为反应物
HRID 58566 方程式

uspto-grants-2016_09 · 10.6084/m9.figshare.5104873.v1 · US09434722B2

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HRID58568

uspto-grants-2016_09

作为反应物
HRID 58568 方程式

uspto-grants-2016_09 · 10.6084/m9.figshare.5104873.v1 · US09434722B2

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HRID58570

uspto-grants-2016_09

作为反应物
HRID 58570 方程式

uspto-grants-2016_09 · 10.6084/m9.figshare.5104873.v1 · US09434722B2

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HRID58665

uspto-grants-2016_09

作为反应物
HRID 58665 方程式

uspto-grants-2016_09 · 10.6084/m9.figshare.5104873.v1 · US09434722B2

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HRID58666

uspto-grants-2016_09

作为反应物
HRID 58666 方程式

uspto-grants-2016_09 · 10.6084/m9.figshare.5104873.v1 · US09434722B2

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