2-(2'-Thienyl)pyridine 分子结构式
HCID76832

2-(2'-Thienyl)pyridine

2-thiophen-2-ylpyridine

C9H7NS161.23 g/molCAS 3319-99-1

IDENTITY

结构与身份

标准SMILES
c1ccc(-c2cccs2)nc1
InChIKey
QLPKTAFPRRIFQX-UHFFFAOYSA-N
分子式
C9H7NS
平均分子量
161.23 g/mol
单同位素质量
161.0299204

COMPUTED

结构计算性质

已同步
XLogP
2.2
极性表面积
41.1 Ų
氢键供体
0
氢键受体
2
可旋转键
1
重原子
11
形式电荷
0
复杂度
127

PROPERTIES

实验与物化性质

来源:PubChem
Solubility

1.9 [ug/mL] (The mean of the results at pH 7.4)

GHS

GHS分类

来源:PubChem
GHS Classification

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (97.9%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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

Aggregated GHS information provided per 47 reports by companies from 7 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

2-(2-Thienyl)pyridine: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Hazard Classes and Categories

Skin Irrit. 2 (100%);Eye Irrit. 2A (100%);STOT SE 3 (97.9%)

REGULATORY

法规信息

来源:PubChem
Regulatory Information

2-(2-Thienyl)pyridine: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

ALIASES

名称与别名

共 48 条
2-(2'-Thienyl)pyridineRefChem:4544602-(Thiophen-2-yl)pyridine2-(2-Thienyl)pyridine3319-99-12-thien-2-ylpyridine2-thiophen-2-ylpyridine2-(2-Pyridyl)thiophene2-thiophen-2-yl-pyridineMFCD00044441Pyridine, 2-(2-thienyl)-2-(thien-2-yl)pyridinethienyl pyridine2-thienylpyridineEINECS 222-022-12-Pyrid-2-ylthiopheneSCHEMBL36011MLS000861939SCHEMBL295633SCHEMBL1201661

REACTIONS

参与反应

14
HRID 221062 反应方程式

uspto-grants-2012_06 · 10.6084/m9.figshare.5104873.v1 · US08202984B2

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HRID 221143 反应方程式

uspto-grants-2012_06 · 10.6084/m9.figshare.5104873.v1 · US08202984B2

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HRID 256844 反应方程式

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

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HRID 289949 反应方程式

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

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HRID 395898 反应方程式

uspto-grants-2003_08 · 10.6084/m9.figshare.5104873.v1 · US06605707B1

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HRID 654494 反应方程式

uspto-grants-1992_07 · 10.6084/m9.figshare.5104873.v1 · US05132310

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HRID 1207915 反应方程式

Training data from https://doi.org/10.1039/C8SC04228D (5/10) · 10.1039/C8SC04228D

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HRID 1376857 反应方程式

uspto-grants-1997_09 · 10.6084/m9.figshare.5104873.v1 · US05663164

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