Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D
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IDENTITY
结构与身份
- 标准SMILES
- FC(F)Oc1ccccc1
- InChIKey
- LMVBQQAXGZVBFH-UHFFFAOYSA-N
- 分子式
- C7H6F2O
- 平均分子量
- 144.12 g/mol
- 单同位素质量
- 144.03867113
COMPUTED
结构计算性质
- XLogP
- 2.4
- 极性表面积
- 9.2 Ų
- 氢键供体
- 0
- 氢键受体
- 3
- 可旋转键
- 2
- 重原子
- 10
- 形式电荷
- 0
- 复杂度
- 89
GHS
GHS分类
GHS Classification
Warning
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P210, P233, P240, P241, P242, P243, P264, P264+P265, P280, P302+P352, P303+P361+P353, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P235, 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
Hazard Classes and Categories
Flam. Liq. 3 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)
ALIASES
名称与别名
(difluoromethoxy)benzene458-92-4alpha,alpha-DifluoroanisoleNSC-265871AF5S75R3NFDTXSID90196623RefChem:1050851DTXCID30119114207-283-1difluoromethoxybenzeneMFCD00068184Benzene, (difluoromethoxy)-a,a-difluoroanisoleEINECS 207-283-1difluorophenoxymethaneNSC265871difluoro-methoxybenzenedifluoromethoxy-benzene(Difluoromethoxy)-benzene3-(difluoromethoxy)benzene
REACTIONS
相关反应
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