IDENTITY
结构与身份
- 标准 SMILES
- CCOCCOC(=O)Cl
- InChIKey
- BAKGFNOISJEFPX-UHFFFAOYSA-N
- 分子式
- C5H9ClO3
- 平均分子量
- 152.57 g/mol
- 单同位素质量
- 152.0240218
COMPUTED
结构计算性质
- XLogP
- 1.4
- 极性表面积
- 35.5 Ų
- 氢键供体
- 0
- 氢键受体
- 3
- 可旋转键
- 5
- 重原子
- 9
- 形式电荷
- 0
- 复杂度
- 84
GHS
GHS 分类
GHS Classification
Danger
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids];H300 (100%): Fatal if swallowed [Danger Acute toxicity, oral];H310 (100%): Fatal in contact with skin [Danger Acute toxicity, dermal];H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation];H330 (100%): Fatal if inhaled [Danger Acute toxicity, inhalation]
P210, P233, P240, P241, P242, P243, P260, P262, P264, P270, P271, P280, P284, P301+P316, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P320, P321, P330, P361+P364, P363, P370+P378, P403+P233, P403+P235, 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
Flam. Liq. 3 (100%);Acute Tox. 2 (100%);Acute Tox. 2 (100%);Skin Corr. 1B (100%);Acute Tox. 2 (100%)
ALIASES
名称与别名
REACTIONS
参与反应
当前筛选下没有反应记录。