HCID45588058

5-Chloro-3-(trifluoromethyl)pyridine-2-carboxylic acid

C7H3ClF3NO2225.55 g/molCAS 1198475-43-2

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IDENTITY

结构与身份

标准SMILES: O=C(O)c1ncc(Cl)cc1C(F)(F)F
InChIKey: WQHJECWXEBZOLJ-UHFFFAOYSA-N
分子式: C7H3ClF3NO2
平均分子量: 225.55 g/mol
单同位素质量: 224.9804405

COMPUTED

结构计算性质

已同步

XLogP: 2.2
极性表面积: 50.2 Å²
氢键供体: 1
氢键受体: 6
可旋转键: 1
重原子: 14
形式电荷: 0
复杂度: 233

GHS

GHS分类

GHS Classification

Warning

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]

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, 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

Hazard Classes and Categories

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

ALIASES

名称与别名

共 16 条

1198475-43-25-chloro-3-(trifluoromethyl)pyridine-2-carboxylic acid5-chloro-3-(trifluoromethyl)-2-pyridinecarboxylic acid5-chloro-3-(trifluoromethyl)picolinic acidMFCD141556432-Pyridinecarboxylic acid, 5-chloro-3-(trifluoromethyl)-5-Chloro-3-trifluoromethylpyridine-2-carboxylic acidSCHEMBL3128646DTXSID50670550YXB47543SBB096867AKOS005073599MD-0714DB-100277CS-03166205-chloro-3-(trifluoromethyl)-2-pyridinecarboxylicacid

REACTIONS