HCID12344836

5-chloro-1-methyl-4-nitro-1H-pyrazole

5-chloro-1-methyl-4-nitropyrazole

C4H4ClN3O2161.55 g/molCAS 42098-25-9

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IDENTITY

结构与身份

标准 SMILES: Cn1ncc([N+](=O)[O-])c1Cl
InChIKey: POXLZEWCWNUVDW-UHFFFAOYSA-N
分子式: C4H4ClN3O2
平均分子量: 161.55 g/mol
单同位素质量: 160.9992041

COMPUTED

结构计算性质

已同步

XLogP: 1
极性表面积: 63.6 Å²
氢键供体: 0
氢键受体: 3
可旋转键: 0
重原子: 10
形式电荷: 0
复杂度: 148

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. 2A (100%)；STOT SE 3 (100%)

ALIASES

名称与别名

共 21 条

5-chloro-1-Methyl-4-nitro-1H-pyrazole42098-25-9DTXSID70492670RefChem:302225DTXCID70443480817-771-15-chloro-1-methyl-4-nitropyrazole5-chloro-1-methyl-4-nitro-pyrazoleMFCD21607270SCHEMBL2521727POXLZEWCWNUVDW-UHFFFAOYSA-NCS-B1287SBA098253-chloro-2-methyl-4-nitro-pyrazoleAKOS016000438DS-5402AC-31217SY040265DB-358808EN300-156975

REACTIONS