1-Hexanol, 6-bromo-, acetate

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: 1-Hexanol, 6-bromo-, acetate
• 英文别名: acetic acid;6-bromohexan-1-ol
• 化学式: C8H17BrO3
• 分子量: 241.12
• InChiKey: ORSNIUUONGZHEH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.02
• 重原子数：
  12
• 可旋转键数：
  5
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.88
• 拓扑面积：
  57.5
• 氢给体数：
  2
• 氢受体数：
  3

ADMET

毒理性

• 致癌性证据

评估：关于人类中石油溶剂的致癌性，证据不足。没有关于特殊沸点溶剂或白醇在实验动物中的致癌性的数据。总体评估：石油溶剂不能被归类为对人类具有致癌性（第3组）。/石油溶剂/

Evaluation: There is inadequate evidence for the carcinogenicity of petroleum solvents in humans. No data were available on the carcinogenicity of special boiling range solvents or white spirits in experimental animals. Overall evaluation: Petroleum solvents are not classifiable as to their carcinogenicity to humans (Group 3). /Petroleum solvents/

来源:Hazardous Substances Data Bank (HSDB)

毒理性

• 致癌性证据

未列出

Not listed

来源:Occupational Safety and Health Administration (OSHA)

毒理性

• 健康影响

健康影响代码：HE8 - 神经系统干扰 - 麻醉

Health Effect Code(s):HE8 - Nervous System Disturbances---Narcosis

来源:Occupational Safety and Health Administration (OSHA)

毒理性

• 暴露途径

该物质可以通过吸入其蒸汽、通过皮肤接触以及摄入进入人体。

The substance can be absorbed into the body by inhalation of its vapour, through the skin and by ingestion.

来源:ILO International Chemical Safety Cards (ICSC)

毒理性

• 暴露途径

吸入，吞食，皮肤和/或眼睛接触

inhalation, ingestion, skin and/or eye contact

来源:The National Institute for Occupational Safety and Health (NIOSH)

吸收、分配和排泄

通常可以预期，Stoddard溶剂中挥发性较高的成分会更容易从肺部进入血液，而不是其他成分。具有较高血/气相溶解度比（如芳烃：取代苯和甲苯）的成分预计会比具有较低比例（如环己烷）的成分更完全地被吸收。

In general, it can be expected that the more highly volatile components of Stoddard solvent would cross from the lungs into the bloodstream more readily than other components. The components with higher blood/gas phase solubility ratios (such as the aromatics: substituted benzenes and toluenes) would be expected to be absorbed more completely than those with lower ratios (such as the cyclohexanes).

来源:Hazardous Substances Data Bank (HSDB)

吸收、分配和排泄

尽管没有找到报告人类和动物吸入或口服暴露后以及人类皮肤接触后排出斯托达德溶剂的研究，但预期斯托达德溶剂中挥发性成分或代谢物，如果血液溶解度低，则最容易通过呼出的气息排出。

Although no studies were found that reported the excretion of Stoddard solvent after inhalation or oral exposure in humans and animals, or after dermal exposure in humans, it is expected that volatile components or metabolites of Stoddard solvent that have low blood solubility would be most easily excreted in exhaled breath.

来源:Hazardous Substances Data Bank (HSDB)

吸收、分配和排泄

人类和动物的研究表明，Stoddard溶剂和白油很容易通过肺部吸收。一般来说，可以预期，具有更高血/气溶解比率的Stoddard溶剂成分（如芳烃）会通过肺部更完全地吸收，而那些比率较低的成分则吸收较少。...没有找到报告口服暴露于Stoddard溶剂后吸收情况的人类或动物研究。然而，从其他石油馏分的研究中可以预期，Stoddard溶剂的某些成分（较小的烷烃或芳烃）可能比其他成分（如较长的C10-C16烷烃链）更容易被吸收。没有找到评估Stoddard溶剂经皮暴露后吸收情况的人类或动物研究，但已知白油在大鼠身上应用后会发生经皮吸收。预期芳烃成分的经皮吸收会比脂肪族成分更大。

Studies in humans and animals have shown that Stoddard solvent and white spirits are readily absorbed through the lungs. In general, it can be expected that Stoddard solvent components such as the aromatics, which have higher blood/gas solubility ratios, would be more completely absorbed through the lungs that those with lower ratios. ... No studies were located that reported the absorption of Stoddard solvent after oral exposure in either humans or animals. However, from studies of other petroleum distillates, it is expected that certain components of Stoddard solvent (smaller alkanes or aromatics) might be more readily absorbed than other components such as longer (C10-C16) alkane chains. Neither human nor animal studies evaluating the absorption of Stoddard solvent after dermal exposure were located, but dermal absorption in rats is known to have occurred after application of white spirits. Aromatic components would be expected to have greater dermal absorption than aliphatic components.

来源:Hazardous Substances Data Bank (HSDB)