Civil and Environmental Engineering, Virginia Tech, Blacksburg, VA 24061, United States.
Civil and Environmental Engineering, Virginia Tech, Blacksburg, VA 24061, United States; Food Science and Technology, Virginia Tech, Blacksburg, VA 24061, United States.
Sci Total Environ. 2015 Dec 15;538:298-305. doi: 10.1016/j.scitotenv.2015.08.050. Epub 2015 Aug 24.
In 2014, crude (4-methylcyclohexyl)methanol (MCHM) spilled, contaminating the drinking water of 300,000 West Virginians and requiring "do not use" orders to protect human health. When the spill occurred, known crude MCHM physicochemical properties were insufficient to predict human inhalation and ingestion exposures. Objectives are (1) determine Henry's Law Constants (HLCs) for 4-MCHM isomers at 7, 25, 40, and 80°C using gas chromatography; (2) predict air concentrations of 4-MCHM and methyl-4-methylcyclohexanecarboxylate (MMCHC) during showering using an established shower model; (3) estimate human ingestion and inhalation exposure to 4-MCHM and MMCHC; and (4) determine if predicted air 4-MCHM exceeded odor threshold concentrations. Dimensionless HLCs of crude cis- and trans-4-MCHM were measured to be 1.42×10(-4)±6% and 3.08×10(-4)±3% at 25°C, respectively, and increase exponentially with temperature as predicted by the van't Hoff equation. Shower air concentrations for cis- and trans-4-MCHM are predicted to be 0.089 and 0.390ppm-v respectively after 10min, exceeding the US EPA's 0.01ppm-v air screening level during initial spill conditions. Human exposure doses were predicted using measured drinking water and predicted shower air concentrations and found to greatly exceed available guidance levels in the days directly following the spill. Odors would be rapidly detected by 50% of individuals at aqueous concentrations below analytical gas chromatographic detection limits. MMCHC, a minor odorous component (0.935%) of crude MCHM, is also highly volatile and therefore is predicted to contribute to inhalation exposures and odors experienced by consumers.
2014 年,粗制(4-甲基环己基)甲醇(MCHM)泄漏,污染了 30 万西弗吉尼亚人的饮用水,需要下达“禁止使用”令以保护人类健康。泄漏发生时,已知的粗制 MCHM 的物理化学性质不足以预测人类吸入和摄入暴露情况。目的是:(1)使用气相色谱法测定 4-MCHM 异构体在 7、25、40 和 80°C 时的亨利定律常数(HLC);(2)使用既定的淋浴模型预测淋浴过程中 4-MCHM 和甲基-4-甲基环己烷羧酸甲酯(MMCHC)的空气浓度;(3)估计人体摄入和吸入 4-MCHM 和 MMCHC 的暴露量;(4)确定预测空气中的 4-MCHM 是否超过气味阈值浓度。测定了粗制顺式和反式 4-MCHM 的无因次 HLC,分别在 25°C 下为 1.42×10(-4)±6%和 3.08×10(-4)±3%,并根据范特霍夫方程预测,随温度呈指数增长。预测顺式和反式 4-MCHM 在 10min 后分别在淋浴空气中的浓度为 0.089 和 0.390ppm-v,超过了美国环保署在初始泄漏条件下 0.01ppm-v 的空气筛选水平。使用测量的饮用水和预测的淋浴空气浓度预测人体暴露剂量,发现暴露剂量在泄漏发生后的几天内大大超过了现有指导水平。在低于分析气相色谱检测限的水相中,有 50%的个体将迅速检测到气味。粗 MCHM 的一种次要气味成分(0.935%)MMCHC 也是高度挥发性的,因此预计会导致消费者的吸入暴露和气味体验。