HRID507910
uspto-grants-2010_08
作为反应物
uspto-grants-2010_08 · 10.6084/m9.figshare.5104873.v1 · US07786165B2
查看条件与参与物IDENTITY
结构与身份
- 标准 SMILES
- c1ccc(CCNc2nc(-c3ccccc3)cs2)cc1
- InChIKey
- WEEYMMXMBFJUAI-UHFFFAOYSA-N
- 分子式
- C17H16N2S
- 平均分子量
- 280.4 g/mol
- 单同位素质量
- 280.10341969
COMPUTED
结构计算性质
- XLogP
- 4.9
- 极性表面积
- 53.2 Ų
- 氢键供体
- 1
- 氢键受体
- 3
- 可旋转键
- 5
- 重原子
- 20
- 形式电荷
- 0
- 复杂度
- 272
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
Fanetizole79069-94-6FanetizolFanetizolumDTXSID9048695BH48F620JA2-Thiazolamine, 4-phenyl-N-(2-phenylethyl)-DTXCID90286214-Phenyl-N-(2-phenylethyl)-2-thiazolamineRefChem:5971532-phenethylamino-4-phenylthiazoleCP-48,8104-phenyl-N-(2-phenylethyl)-1,3-thiazol-2-amineN-Phenethyl-4-phenylthiazol-2-amine2-Thiazolamine,4-phenyl-N-(2-phenylethyl)-MFCD00867578NCGC00160438-01CAS-79069-94-6Fanetizol [Spanish]Fanetizolum [Latin]
REACTIONS
参与反应
HRID507941
uspto-grants-2010_08
作为反应物
uspto-grants-2010_08 · 10.6084/m9.figshare.5104873.v1 · US07786165B2
查看条件与参与物HRID732174
uspto-grants-2009_09
作为反应物
uspto-grants-2009_09 · 10.6084/m9.figshare.5104873.v1 · US07585880B2
查看条件与参与物HRID942927
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HRID950302
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HRID1163302
uspto-grants-2010_10
作为反应物
uspto-grants-2010_10 · 10.6084/m9.figshare.5104873.v1 · US07820837B2
查看条件与参与物