HRID2072338
uspto-grants-1977_09
作为反应物
uspto-grants-1977_09 · 10.6084/m9.figshare.5104873.v1 · US04051153
查看条件与参与物IDENTITY
结构与身份
- 标准 SMILES
- CC(CO)C(=O)O
- InChIKey
- DBXBTMSZEOQQDU-UHFFFAOYSA-N
- 分子式
- C4H8O3
- 平均分子量
- 104.1 g/mol
- 单同位素质量
- 104.04734411
COMPUTED
结构计算性质
- XLogP
- -0.4
- 极性表面积
- 57.5 Ų
- 氢键供体
- 2
- 氢键受体
- 3
- 可旋转键
- 2
- 重原子
- 7
- 形式电荷
- 0
- 复杂度
- 69
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)
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
Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)
ALIASES
名称与别名
3-Hydroxyisobutyric acid2068-83-93-Hydroxy-2-methylpropanoic acidK75C8JDF5WCHEBI:18064DTXSID20862824RefChem:911411DTXCID50811542819-819-7propanoic acid, 3-hydroxy-2-methyl-2-Methyl-3-hydroxypropanoic Acidrac 3-Hydroxyisobutyric AcidMFCD11975300(R)-2-Hydroxymethylpropanoic acidbeta-hydroxyisobutyric acid3-hydroxy-2-methylpropionic acid3-hydroxy-2-methyl-propanoic acidUNII-K75C8JDF5WDL-3-Hydroxyisobutyric Acidrac-3-Hydroxyisobutyric acid
REACTIONS