HCID45480320

8-Bromo-7-fluoro-2-methoxy-1,5-naphthyridine

C9H6BrFN2O257.06 g/molCAS 724788-70-9

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IDENTITY

结构与身份

标准SMILES: COc1ccc2ncc(F)c(Br)c2n1
InChIKey: KBDDFKYRMCBPOT-UHFFFAOYSA-N
分子式: C9H6BrFN2O
平均分子量: 257.06 g/mol
单同位素质量: 255.96475

COMPUTED

结构计算性质

已同步

XLogP: 2.3
极性表面积: 35 Å²
氢键供体: 0
氢键受体: 4
可旋转键: 1
重原子: 14
形式电荷: 0
复杂度: 207

GHS

GHS分类

来源：PubChem

GHS Classification

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H332 (100%): 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)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

HAZARDS

危害信息

来源：PubChem

Hazard Classes and Categories

Acute Tox. 4 (100%)；Acute Tox. 4 (100%)；Acute Tox. 4 (100%)

ALIASES

名称与别名

共 20 条

8-bromo-7-fluoro-2-methoxy-1,5-naphthyridine724788-70-9DTXSID60670304RefChem:311855DTXCID60621053807-228-7MFCD09027615SCHEMBL592407SCHEMBL29692870KBDDFKYRMCBPOT-UHFFFAOYSA-NAKOS016001870SY258982DB-074569CS-00892164-Bromo-3-fluoro-6-methoxy-[1,5]naphthyridine4-Bromo-3-fluoro-6-methoxy-[1.5]naphthyridine8-bromo-7-fluoro-2-methoxy-[1,5]naphthyridine8-Bromo-7-fluoro-2-(methoxy)-1,5-naphthyridineF2216098-bromo-7-fluoro-2-(methyloxy)-1,5-naphthyridine

REACTIONS

参与反应

41 条

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 (6/10) · 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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uspto-grants-2016_05 · 10.6084/m9.figshare.5104873.v1 · US09346804B2

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uspto-grants-2010_04 · 10.6084/m9.figshare.5104873.v1 · US07691850B2

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uspto-grants-2010_04 · 10.6084/m9.figshare.5104873.v1 · US07691850B2

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uspto-grants-2011_12 · 10.6084/m9.figshare.5104873.v1 · US08071592B2

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uspto-grants-2011_12 · 10.6084/m9.figshare.5104873.v1 · US08071592B2

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