HCID2773271

5-Bromo-2-phenyl-1,3-oxazole

C9H6BrNO224.05 g/molCAS 92629-11-3

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IDENTITY

结构与身份

标准 SMILES: Brc1cnc(-c2ccccc2)o1
InChIKey: MSXVETKZQOUBNB-UHFFFAOYSA-N
分子式: C9H6BrNO
平均分子量: 224.05 g/mol
单同位素质量: 222.96328

COMPUTED

结构计算性质

已同步

XLogP: 3
极性表面积: 26 Å²
氢键供体: 0
氢键受体: 2
可旋转键: 1
重原子: 12
形式电荷: 0
复杂度: 147

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 20 条

5-bromo-2-phenyl-1,3-oxazoleRefChem:533367853-765-55-bromo-2-phenyloxazole92629-11-3MFCD00466256Oxazole, 5-bromo-2-phenyl-5-bromo-2-phenyl-OxazoleSCHEMBL84546DTXSID30378325MSXVETKZQOUBNB-UHFFFAOYSA-NOXAZOLE,5-BROMO-2-PHENYL-AKOS015835700AC-33811AS-19746SY104153DB-079367EN300-716104F2219155-bromo-2-phenyloxazole, 92629-11-3, 5-bromo-2-phenyl-1,3-oxazole, AG-H-79449, AC1MCMPC, SureCN84546, CTK5H1533, MolPort-001-759-065, ANW-59270, AKOS015835700, RL05833, AK-40252, KB-42185, AB1010315, Y6510, I14-13004

REACTIONS

参与反应

2 条

全部作为反应物作为生成物作为试剂作为催化剂作为溶剂

HRID751283

uspto-grants-2008_07

作为反应物

uspto-grants-2008_07 · 10.6084/m9.figshare.5104873.v1 · US07405299B2

查看条件与参与物

HRID939029

Validation data from https://doi.org/10.1039/C8SC04228D

作为反应物

Validation data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D

查看条件与参与物