结构:COc1cccc2ocnc12
HCID22500935

4-Methoxybenzo(d)oxazole

4-methoxy-1,3-benzoxazole

C8H7NO2149.15 g/molCAS 192753-32-5

IDENTITY

结构与身份

标准 SMILES
COc1cccc2ocnc12
InChIKey
VHCOEXCZDAHYMW-UHFFFAOYSA-N
分子式
C8H7NO2
平均分子量
149.15 g/mol
单同位素质量
149.04767847

COMPUTED

结构计算性质

已同步
XLogP
1.7
极性表面积
35.3 Ų
氢键供体
0
氢键受体
3
可旋转键
1
重原子
11
形式电荷
0
复杂度
140

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.

ALIASES

名称与别名

17
4-Methoxybenzo[d]oxazole192753-32-54-Methoxybenzo(d)oxazoleRefChem:524725971-114-44-methoxy-1,3-benzoxazole4-MethoxybenzoxazoleBenzoxazole,4-Methoxy-MFCD13176880SCHEMBL645599SCHEMBL940312VHCOEXCZDAHYMW-UHFFFAOYSA-NBS-52043DB-332407CS-0160865D83924F690413

REACTIONS

参与反应

4
HRID1552120

Training data from https://doi.org/10.1039/C8SC04228D (1/10)

作为反应物
HRID 1552120 方程式

Training data from https://doi.org/10.1039/C8SC04228D (1/10) · 10.1039/C8SC04228D

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