uspto-grants-2015_03 · 10.6084/m9.figshare.5104873.v1 · US08987256B2
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IDENTITY
结构与身份
- 标准SMILES
- O=C1NCc2c(F)cccc21
- InChIKey
- GAHFFZDPDRNMNC-UHFFFAOYSA-N
- 分子式
- C8H6FNO
- 平均分子量
- 151.14 g/mol
- 单同位素质量
- 151.04334198
COMPUTED
结构计算性质
- XLogP
- 0.9
- 极性表面积
- 29.1 Ų
- 氢键供体
- 1
- 氢键受体
- 2
- 可旋转键
- 0
- 重原子
- 11
- 形式电荷
- 0
- 复杂度
- 183
GHS
GHS分类
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
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
366452-96-24-Fluoro-2,3-dihydro-1H-isoindol-1-oneRefChem:523050856-005-04-FLUOROISOINDOLIN-1-ONE4-FLUORO-2,3-DIHYDROISOINDOL-1-ONEMFCD131777561H-Isoindol-1-one,4-fluoro-2,3-dihydro-(9CI)4-fluoro-2,3-dihydro-isoindol-1-one4-Fluoro-1-isoindolinone1H-ISOINDOL-1-ONE, 4-FLUORO-2,3-DIHYDRO-SCHEMBL1078443SCHEMBL29871952GAHFFZDPDRNMNC-UHFFFAOYSA-NAKOS024016077AB66630NCGC01453217-01AS-66299DB-267852CS-0062221
REACTIONS
