4-(Pyridin-3-yl)aniline 分子结构式
HCID459522

4-(Pyridin-3-yl)aniline

4-pyridin-3-ylaniline

C11H10N2170.21 g/molCAS 82261-42-5

IDENTITY

结构与身份

标准SMILES
Nc1ccc(-c2cccnc2)cc1
InChIKey
DKFDPLVNPGJNDE-UHFFFAOYSA-N
分子式
C11H10N2
平均分子量
170.21 g/mol
单同位素质量
170.08439833

COMPUTED

结构计算性质

已同步
XLogP
1.8
极性表面积
38.9 Ų
氢键供体
1
氢键受体
2
可旋转键
1
重原子
13
形式电荷
0
复杂度
150

GHS

GHS分类

来源:PubChem
GHS Classification

Warning

H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral];H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H332 (50%): Harmful if inhaled [Warning Acute toxicity, inhalation];H335 (100%): 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, P317, 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 2 reports by companies from 2 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 (50%);Skin Irrit. 2 (100%);Eye Irrit. 2A (100%);Acute Tox. 4 (50%);STOT SE 3 (100%)

ALIASES

名称与别名

共 41 条
4-(pyridin-3-yl)anilineRefChem:516832674-609-04-pyridin-3-ylaniline82261-42-54-(3-Pyridyl)aniline4-pyridin-3-yl-phenylamine3-(4-aminophenyl)pyridineMFCD00956763Benzenamine, 4-(3-pyridinyl)-4-Pyridin-3-yl aniline4-Pyridin-3-ylphenylamine4-(3-pyridinyl)aniline4-(3-pyridyl)phenylamine3-(p-Aminophenyl)pyridine4-(pyridine-3-yl)aniline3-(4'-aminophenyl)pyridine3-(4-aminophenyl)-pyridine4-(Pyridin-3-yl)phenylamineSCHEMBL225149

REACTIONS

参与反应

41
HRID 162319 反应方程式

Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D

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HRID 213280 反应方程式

Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D

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HRID 256842 反应方程式

uspto-grants-1993_11 · 10.6084/m9.figshare.5104873.v1 · US05260294

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HRID 290548 反应方程式

Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D

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HRID 298560 反应方程式

Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D

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HRID 322060 反应方程式

uspto-grants-2001_04 · 10.6084/m9.figshare.5104873.v1 · US06211220B1

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HRID 332786 反应方程式

uspto-grants-2014_11 · 10.6084/m9.figshare.5104873.v1 · US08877760B2

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HRID 332787 反应方程式

uspto-grants-2014_11 · 10.6084/m9.figshare.5104873.v1 · US08877760B2

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