HCID736673

4,6-Dichloro-2-phenylpyrimidin-5-amine

C10H7Cl2N3240.09 g/molCAS 20959-02-8

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IDENTITY

结构与身份

标准 SMILES: Nc1c(Cl)nc(-c2ccccc2)nc1Cl
InChIKey: WYMSKTBVPZTMHU-UHFFFAOYSA-N
分子式: C10H7Cl2N3
平均分子量: 240.09 g/mol
单同位素质量: 239.0017026

COMPUTED

结构计算性质

已同步

XLogP: 3.1
极性表面积: 51.8 Å²
氢键供体: 1
氢键受体: 3
可旋转键: 1
重原子: 15
形式电荷: 0
复杂度: 197

PROPERTIES

实验与物化性质

来源：PubChem

Solubility

7.9 [ug/mL] (The mean of the results at pH 7.4)

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%)

ALIASES

名称与别名

共 26 条

4,6-dichloro-2-phenylpyrimidin-5-amine20959-02-8DTXSID00353083RefChem:285790DTXCID50304146820-107-35-Pyrimidinamine, 4,6-dichloro-2-phenyl-5-Amino-4,6-dichloro-2-phenylpyrimidineMFCD005202514,6-dichloro-2-phenyl-5-pyrimidinamineMLS001004608SCHEMBL4663325CHEMBL1581179WYMSKTBVPZTMHU-UHFFFAOYSA-NHMS1754L16AKOS002528566SB580294,6-dichloro-2-phenyl-pyrimidin-5-amineSMR0003481744,6-dichloro-2-phenylpyrimidine-5-ylamine

REACTIONS

参与反应

0 条

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