HCID17770161

(2-Fluorophenyl)acetaldehyde

2-(2-fluorophenyl)acetaldehyde

C8H7FO138.14 g/molCAS 75321-85-6

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IDENTITY

结构与身份

标准SMILES: O=CCc1ccccc1F
InChIKey: NSEOYYODXJXMMP-UHFFFAOYSA-N
分子式: C8H7FO
平均分子量: 138.14 g/mol
单同位素质量: 138.04809301

COMPUTED

结构计算性质

已同步

XLogP: 1.6
极性表面积: 17.1 Å²
氢键供体: 0
氢键受体: 2
可旋转键: 2
重原子: 10
形式电荷: 0
复杂度: 114

GHS

GHS分类

来源：PubChem

GHS Classification

Warning

H227 (100%): Combustible liquid [Warning Flammable liquids]；H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；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]

P210, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P403, 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

Flam. Liq. 4 (100%)；Acute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)

ALIASES

名称与别名

共 25 条

75321-85-6(2-Fluorophenyl)acetaldehydeDTXSID70590903RefChem:206040DTXCID205416672-(2-Fluorophenyl)Acetaldehyde2-Fluorobenzeneacetaldehyde2-FluorophenylacetaldehydeMFCD02261759(2-Fluoro-phenyl)-acetaldehydeSCHEMBL168715SCHEMBL1759676SCHEMBL2139391SCHEMBL30079047NSEOYYODXJXMMP-UHFFFAOYSA-NAKOS011896714SB85373BS-17519SY292994DB-031886

REACTIONS

参与反应

9 条

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

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Training data from https://doi.org/10.1039/C8SC04228D (7/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (7/10) · 10.1039/C8SC04228D

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uspto-grants-1980_05 · 10.6084/m9.figshare.5104873.v1 · US04204071

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uspto-grants-2011_10 · 10.6084/m9.figshare.5104873.v1 · US08039514B2

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uspto-grants-2010_09 · 10.6084/m9.figshare.5104873.v1 · US07795292B2

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uspto-grants-2012_05 · 10.6084/m9.figshare.5104873.v1 · US08178571B2

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uspto-grants-2009_08 · 10.6084/m9.figshare.5104873.v1 · US07576215B2

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