HRID1089827
uspto-grants-1992_01
作为反应物
uspto-grants-1992_01 · 10.6084/m9.figshare.5104873.v1 · US05079260
查看条件与参与物IDENTITY
结构与身份
- 标准 SMILES
- Cc1ccc2c(c1)Cc1ccccc1-2
- InChIKey
- RKJHJMAZNPASHY-UHFFFAOYSA-N
- 分子式
- C14H12
- 平均分子量
- 180.24 g/mol
- 单同位素质量
- 180.09390038
COMPUTED
结构计算性质
- XLogP
- 4.5
- 极性表面积
- 0 Ų
- 氢键供体
- 0
- 氢键受体
- 0
- 可旋转键
- 0
- 重原子
- 14
- 形式电荷
- 0
- 复杂度
- 208
PROPERTIES
实验与物化性质
Kovats Retention Index
1694.8；1712.7；1676；1678.1；1684；287.7；288.2
1720；1673；1673；287.75；277.2；288.28；288.28；288.29；288.42；288.7；287.7；288.21；288.4；272.1；287.7；288.09；288.78；288.21；288.22；286.72
GHS
GHS 分类
GHS Classification
Warning
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, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
HAZARDS
危害信息
Hazard Classes and Categories
Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (100%)
ALIASES
名称与别名
2-Methyl-9H-fluorene2-METHYLFLUORENE1430-97-39H-Fluorene, 2-methyl-2DUC7EB9MCEINECS 215-853-6NSC 90365NSC-90365FLUORENE,2-METHYL-DTXSID1073943RefChem:476049DTXCID80346619H-Fluorene, 2-methyl-(9CI)215-853-6MFCD00040873Fluorene, 2-methyl-26914-17-0UNII-2DUC7EB9MCNSC903652-Methyl-9H-fluorene #
REACTIONS
参与反应
HRID1648146
uspto-grants-1995_07
作为反应物
uspto-grants-1995_07 · 10.6084/m9.figshare.5104873.v1 · US05434264
查看条件与参与物HRID1681776
uspto-grants-1992_12
作为反应物
uspto-grants-1992_12 · 10.6084/m9.figshare.5104873.v1 · US05173489
查看条件与参与物HRID2349742
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
作为反应物
Training data from https://doi.org/10.1039/C8SC04228D (10/10) · 10.1039/C8SC04228D
查看条件与参与物