概述
1,2,4-butanetriol is a triol that is butane carrying three hydroxy substituents at position 1, 2 and 4. It has a role as an Escherichia coli metabolite and a bacterial xenobiotic metabolite. It derives from a hydride of a butane.
名称与标识
- 首选名称
- 1,2,4-Butanetriol
- IUPAC
- butane-1,2,4-triol
- 英文名
- butane-1,2,4-triol
- 分子式
- C4H10O3
- 分子量
- 0
名称与别名
展开更多名称
数据库标识
- CAS
6810-31-7- ChEMBL
CHEMBL1356759- ChEBI
CHEBI:88063- UNII
- NK798C370H
- EC Number
- 221-323-5
- Nikkaji
- J71.197G
性质
结构计算性质
- XLogP
- -1.4
- 极性表面积
- 60.7 Ų
- 氢键供体
- 3
- 氢键受体
- 3
- 可旋转键
- 3
- 重原子
- 7
- 形式电荷
- 0
- 复杂度
- 37.9
实验与物化性质
Physical Description
Liquid
Colorless to yellow liquid, miscible in water; [MSDSonline]
安全与法规
GHS分类
GHS Classification
This chemical does not meet GHS hazard criteria for 1.1% (1 of 92) of reports.
Warning
H315 (98.9%): Causes skin irritation [Warning Skin corrosion/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 92 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
危害信息
Regulatory Information
1,2,4-Butanetriol is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1,2,4-Butanetriol are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
1,2,4-Butanetriol: Does not have an individual approval but may be used under an appropriate group standard
化学与工业
用途与制造
General Manufacturing Information
Other (requires additional information)
1,2,4-Butanetriol: ACTIVE
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相关反应
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