HCID20574023

2-(2,2,2-Trifluoroethanesulfinyl)acetic acid

2-(2,2,2-trifluoroethylsulfinyl)acetic acid

C4H5F3O3S190.14 g/molCAS 60543-27-3

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IDENTITY

结构与身份

标准SMILES: O=C(O)CS(=O)CC(F)(F)F
InChIKey: FIAZTSFGZORROG-UHFFFAOYSA-N
分子式: C4H5F3O3S
平均分子量: 190.14 g/mol
单同位素质量: 189.99114968

COMPUTED

结构计算性质

已同步

XLogP: 0.1
极性表面积: 73.6 Å²
氢键供体: 1
氢键受体: 7
可旋转键: 3
重原子: 11
形式电荷: 0
复杂度: 176

GHS

GHS分类

来源：PubChem

GHS Classification

Danger

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (100%): Causes serious eye damage [Danger 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+P354+P338, P317, P319, P321, P332+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 Dam. 1 (100%)；STOT SE 3 (100%)

ALIASES

名称与别名

共 14 条

2-(2,2,2-trifluoroethanesulfinyl)acetic acidRefChem:451575960-486-360543-27-32,2,2-trifluoroethylsulfinylacetic acidAcetic acid, [(2,2,2-trifluoroethyl)sulfinyl]-2-(2,2,2-trifluoroethylsulfinyl)acetic acidSCHEMBL11393456SCHEMBL11459181DTXSID50608878(2,2,2-Trifluoroethanesulfinyl)acetic acidCS-02490432-((2,2,2-Trifluoroethyl)sulfinyl)acetic acidEN300-4228838

REACTIONS