HCID2734681

Quinoxaline-2-carbonyl chloride

C9H5ClN2O192.6 g/molCAS 54745-92-5

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IDENTITY

结构与身份

标准SMILES: O=C(Cl)c1cnc2ccccc2n1
InChIKey: SOPDQKNXOCUBSR-UHFFFAOYSA-N
分子式: C9H5ClN2O
平均分子量: 192.6 g/mol
单同位素质量: 192.0090405

COMPUTED

结构计算性质

已同步

XLogP: 2.6
极性表面积: 42.9 Å²
氢键供体: 0
氢键受体: 3
可旋转键: 1
重原子: 13
形式电荷: 0
复杂度: 210

GHS

GHS分类

GHS Classification

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]

P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 40 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

Hazard Classes and Categories

Skin Corr. 1B (100%)；Eye Dam. 1 (100%)

ALIASES

名称与别名

共 27 条

Quinoxaline-2-carbonyl chloride54745-92-52-Quinoxalinecarbonyl chlorideEINECS 259-315-9DTXSID90203205RefChem:872070DTXCID50125696259-315-92-Quinoxaloyl chloride2-QuinoxalinecarbonylchlorideMFCD00006725MLT97E8ND22-quinoxaloylchlorideUNII-MLT97E8ND2quinoxaline-2-carbonylchlorideSCHEMBL2195442-quinoxalinylcarbonyl chloride2-quinoxaline carbonyl chlorideSBB000309AKOS015854322

REACTIONS

相关反应

60 条

uspto-grants-1993_09 · 10.6084/m9.figshare.5104873.v1 · US05246948

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Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

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

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uspto-grants-1995_02 · 10.6084/m9.figshare.5104873.v1 · US05389658

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

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

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Training data from https://doi.org/10.1039/C8SC04228D (3/10) · 10.1039/C8SC04228D

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