HCID83192

4,6-Dichloro-2-methyl-5-nitropyrimidine

C5H3Cl2N3O2208 g/molCAS 13162-43-1

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IDENTITY

结构与身份

标准SMILES: Cc1nc(Cl)c([N+](=O)[O-])c(Cl)n1
InChIKey: OPXGPTXSLFZVCA-UHFFFAOYSA-N
分子式: C5H3Cl2N3O2
平均分子量: 208 g/mol
单同位素质量: 206.9602317

COMPUTED

结构计算性质

已同步

XLogP: 2.4
极性表面积: 71.6 Å²
氢键供体: 0
氢键受体: 4
可旋转键: 0
重原子: 12
形式电荷: 0
复杂度: 174

GHS

GHS分类

来源：PubChem

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

来源：PubChem

Hazard Classes and Categories

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

USES

用途与制造

来源：PubChem

General Manufacturing Information

Pyrimidine, 4,6-dichloro-2-methyl-5-nitro-: INACTIVE

ALIASES

名称与别名

共 29 条

4,6-Dichloro-2-methyl-5-nitropyrimidinePyrimidine, 4,6-dichloro-2-methyl-5-nitro-EINECS 236-105-5DTXSID4065367RefChem:96622DTXCID1034056236-105-5OPXGPTXSLFZVCA-UHFFFAOYSA-N13162-43-1MFCD000605274,6-Dichloro-2-methyl-5-nitro-pyrimidine2-methyl-4,6-dichloro-5-nitropyrimidineSCHEMBL1123974AKOS002662681CS-W000839GS-5777SB60475AC-23042SY0213802-methyl-4,6-dichloro-5-nitro-pyrimidine

REACTIONS

参与反应

143 条

uspto-grants-1998_03 · 10.6084/m9.figshare.5104873.v1 · US05732717

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Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D

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