uspto-grants-1993_11 · 10.6084/m9.figshare.5104873.v1 · US05258523
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IDENTITY
结构与身份
- 标准SMILES
- O=C(Cl)CC(=O)CCl
- InChIKey
- WSHVQVCBPLNREW-UHFFFAOYSA-N
- 分子式
- C4H4Cl2O2
- 平均分子量
- 154.98 g/mol
- 单同位素质量
- 153.9588348
COMPUTED
结构计算性质
- XLogP
- 1.2
- 极性表面积
- 34.1 Ų
- 氢键供体
- 0
- 氢键受体
- 2
- 可旋转键
- 3
- 重原子
- 8
- 形式电荷
- 0
- 复杂度
- 111
GHS
GHS分类
GHS Classification
H411 (100%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
P273, P391, 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
Regulatory Information
Chemical: Butanoyl chloride, 4-chloro-3-oxo-
Other Safety Information
Evaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Hazard Classes and Categories
Aquatic Chronic 2 (100%)
REGULATORY
法规信息
Regulatory Information
Chemical: Butanoyl chloride, 4-chloro-3-oxo-
ALIASES
名称与别名
4-chloro-3-oxobutanoyl chloride4-Chloro-3-oxobutyryl chloride41295-64-1EINECS 255-301-1Butanoyl chloride, 4-chloro-3-oxo-DTXSID90194280RefChem:521383DTXCID00116771255-301-1Butanoyl chloride,4-chloro-3-oxo-4-Chloroacetoacetyl chloridegamma-chloroacetoacetyl chlorideFDJ3RDX5VF3-oxo-4-chlorobutyryl chlorideSCHEMBL50000824-Chloro-3-Oxo-Butanoyl Chloridegamma-chloroacetoacetic acid chlorideAKOS006386912NS00030960
REACTIONS
相关反应
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