HCID96016

9H-Fluoren-9-one, 2-fluoro-

2-fluorofluoren-9-one

C13H7FO198.19 g/molCAS 343-01-1

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IDENTITY

结构与身份

标准SMILES: O=C1c2ccccc2-c2ccc(F)cc21
InChIKey: CNCFLCLXJBPMIR-UHFFFAOYSA-N
分子式: C13H7FO
平均分子量: 198.19 g/mol
单同位素质量: 198.04809301

COMPUTED

结构计算性质

已同步

XLogP: 3.7
极性表面积: 17.1 Å²
氢键供体: 0
氢键受体: 2
可旋转键: 0
重原子: 15
形式电荷: 0
复杂度: 276

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 (100%): 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)

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

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

ALIASES

名称与别名

共 31 条

2-Fluoro-9H-fluoren-9-one9H-Fluoren-9-one, 2-fluoro-Fluoren-9-one, 2-fluoro-2-FluorofluorenoneDTXSID70187857NSC 48261RefChem:549949DTXCID30110348640-836-92-Fluoro-9-fluorenone343-01-12-fluorofluoren-9-one2-FLUORO-9-FLUORENONE-9-13CMFCD00001150334973-78-32-Fluoro-fluoren-9-oneNSC48261SCHEMBL1817222-fluoro-9 h-fluoren-9-oneorb3144168

REACTIONS

参与反应

6 条

Validation data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D

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uspto-grants-1990_11 · 10.6084/m9.figshare.5104873.v1 · US04968809

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

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uspto-grants-1984_03 · 10.6084/m9.figshare.5104873.v1 · US04438272

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uspto-grants-2002_05 · 10.6084/m9.figshare.5104873.v1 · US06387893B1

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Training data from https://doi.org/10.1039/C8SC04228D (4/10) · 10.1039/C8SC04228D

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