HCID22319065

3-Bromo-1-phenyl-5-(pyridin-2-yl)-1,2-dihydropyridin-2-one

3-bromo-1-phenyl-5-pyridin-2-ylpyridin-2-one

C16H11BrN2O327.17 g/molCAS 381248-06-2

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IDENTITY

结构与身份

标准SMILES: O=c1c(Br)cc(-c2ccccn2)cn1-c1ccccc1
InChIKey: GSESXDVCGLBTLD-UHFFFAOYSA-N
分子式: C16H11BrN2O
平均分子量: 327.17 g/mol
单同位素质量: 326.00548

COMPUTED

结构计算性质

已同步

XLogP: 3
极性表面积: 33.2 Å²
氢键供体: 0
氢键受体: 2
可旋转键: 2
重原子: 20
形式电荷: 0
复杂度: 438

GHS

GHS分类

来源：PubChem

GHS Classification

This chemical does not meet GHS hazard criteria for 66.7% (2 of 3) of all reports.

Warning

H302 (33.3%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (33.3%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H332 (33.3%): Harmful if inhaled [Warning Acute toxicity, inhalation]

P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 3 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Reported as not meeting GHS hazard criteria per 2 of 3 reports by companies.；There is 1 notification provided by 1 of 3 reports by companies with hazard statement code(s).；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: 17-02-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/34535

Hazard Classes and Categories

Acute Tox. 4 (33.3%)；Acute Tox. 4 (33.3%)；Acute Tox. 4 (33.3%)

REGULATORY

法规信息

来源：PubChem

Regulatory Information

Status: Active Update: 17-02-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/34535

ALIASES

名称与别名

共 30 条

3-bromo-1-phenyl-5-(pyridin-2-yl)-1,2-dihydropyridin-2-oneRefChem:498263800-315-0381248-06-23-bromo-5-(2-pyridyl)-1-phenyl-1,2-dihydropyridin-2-one5'-broMo-1'-phenyl-[2,3'-bipyridin]-6'(1'H)-one3-bromo-1-phenyl-5-pyridin-2-ylpyridin-2-oneMFCD216073923-BROMO-1-PHENYL-5-(PYRIDIN-2-YL)PYRIDIN-2(1H)-ONE[2,3'-Bipyridin]-6'(1'H)-one, 5'-bromo-1'-phenyl-5'-Bromo-1'-phenyl[2,3'-bipyridin]-6'(1'H)-onePyronoprene Impurity 203-Bromo-1-phenyl-5-(pyridin-2-yl)-2(1H)-pyridone; 5'-Bromo-1'-phenyl-[2,3'-bipyridin]-6'(1'H)-one;AX2T252GNESCHEMBL688116DTXSID90624698GSESXDVCGLBTLD-UHFFFAOYSA-NAKOS016028484CH-0052SY258272

REACTIONS

参与反应

46 条

全部作为反应物作为生成物作为试剂作为催化剂作为溶剂

HRID136253

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

作为反应物

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

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HRID137380

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

作为反应物

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

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HRID229673

uspto-grants-2009_07

作为反应物