异氰酸甲酯 methyl isocyanate

概况

异氰酸甲酯化学式
  • 中文名称

    异氰酸甲酯; (甲基亚氨基)(氧代)甲烷

  • 英文名称

    methyl isocyanate; isocyanatomethane

  • 化学式

    C2H3NO

  • 分子量

    57.05

  • 分类属性

    开链化合物二碳

  • 类药性

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编码系统

物化性质

  • 物理描述 Physical Description

    Methyl isocyanate appears as a colorless low-boiling liquid (b.p. 39°C) that is denser than water. Flash point is less than 20° F. Very toxic by inhalation. Can be absorbed through the skin. Has a sharp odor, but the sense of smell cannot be relied upon to warn of the presence of vapors at low concentrations. Rate of onset: Immediate Persistence: Minutes to hours Odor threshold: 2.1 ppm Source/use/other hazard: Intermediate in manufacturing; reacts with H20 (don't use in fire).

  • 颜色/状态 Color Form

    Colorless liquid

  • 气味 Odor

    Sharp, unpleasant odor

  • 沸点 Boiling Point

    39.5 °C

  • 熔点 Melting Point

    -45.0 °C

  • 闪点 Flash Point

    19 °F (-7 °C) (Closed cup)

  • 溶解度 Solubility

    In water, 2.9X10+4 mg/L at 25 °C (est)

  • 密度 Density

    0.9230 g/cu cm at 27 °C

  • 蒸气密度 Vapor Density

    About twice as heavy as air (EPA, 1998) (Relative to Air)

  • 蒸汽压力 Vapor Pressure

    348 mm Hg at 20 °C

  • 自燃温度 Autoignition Temperature

    994 °F (534 °C)

  • 分解 Decomposition

    The substance decomposes on contact with water. The substance decomposes rapidly on contact with acids and bases producing toxic gases (hydrogen cyanide, nitrogen oxides, carbon monoxide).

  • 腐蚀性 Corrosivity

    Methyl isocyanate diffuses through polyethylene and attacks most elastomers (fluorocarbon resins are resistant). It is dangerous to use materials other than stainless steel, nickel, or glass/ceramic in contact with methyl isocyanate. In particular, do not use iron, steel, zinc, tin, copper, or their alloys.

  • 燃烧热 Heat Of Combustion

    269.4 KCAL/G MOL WT (LIQ)

  • 电离电位 Ionization Potential

    10.67 eV

  • 气味阈值 Odor Threshold

    The odor warning when the exposure limit value is exceeded is insufficient.

  • 折光率 Refractive Index

    Index of refraction = 1.3419 at 18 °C

  • 保留指数 Kovats Retention Index

    502

  • 其他实验性质 Other Experimental Properties

    Henry's Law constant = 9.3X10-4 atm-cu m/mol at 25 °C (est)

  • 聚合 Polymerization

    The substance will polymerize when pure. The substance may polymerize due to heating and under the influence of metals and catalysts.

  • 辛醇/水分配系数 LogP

    log Kow = 0.79 (est)

计算性质

  • 辛醇/水分配系数 LogP

    1.1

  • 重原子数 Heavy atoms count

    4

  • 可旋转键数 Rotatable bond count

    0

  • 环数 Number of rings

    0

  • sp3杂化的碳原子比例 Carbon bond saturation (Fsp3)

    0.5

  • 拓扑面积 Polar surface area (Å)

    29.4

  • 氢给体数 Hydrogen bond donors count

    0

  • 氢受体数 Hydrogen bond acceptors count

    2

分类

ADME

吸收、分配和排泄
代谢
吸收、分配和排泄

... Female Wistar rats were given (14)C labeled /methyl isocyanate/ by ip injection or inhalation exposure, and free and protein bound radioactivity was determined in blood, brain, liver, kidney and lung samples. ... Free and protein bound radioactivity were present in all tissues within 30 minutes of the injection of methyl isocyanate at doses of 15 and 30 mg/kg. The relative order of activity in the tissues for both forms of radioactivity from highest to lowest was kidneys, liver, lung, brain, blood hemolysate. Brain radioactivity remained constant over a 10 day period during which the activity of the other tissues decreased. Radioactivity was present in the globin fractions of blood proteins and the hydantoin fractions of blood and tissue proteins. Methyl isocyanate exposure by inhalation produced comparable results.

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代谢

The uptake and distribution of methyl isocyanate were studied in guinea pigs and mice. Male English guinea pigs ... were exposed to 0.5 to 15 ppm of (14)C labeled methyl isocyanate vapor for 1 to 6 hours. ... . Male and pregnant female Swiss Webster mice were exposed to 2.10 ppm of (14)C labeled methyl isocyanate for 6 hours. ... Methyl isocyanate derived (14)C activity was detected in venous and arterial blood within minutes of exposure; however, blood methyl isocyanate concentrations in animals exposed by way of the tracheal cannula were much lower than in those which breathed normally. Methyl isocyanate was cleared slowly from the blood; most of it was cleared within 3 days. Methyl isocyanate was cleared more rapidly from the urine than from bile. The highest concentrations of methyl isocyanate in male mice 2 hours after exposure were found in the lung, sternum, gastrointestinal tract, spleen, and kidney. Twenty four hours after exposure, highest methyl isocyanate concentrations were in the blood and lung. In female mice the highest concentrations at 2 hours after exposure were found in the lung, fetus, spleen, uterus, and kidney. After 24 hours the highest concentrations were in the lung, spleen, and fetus. /It was/ concluded that inhaled methyl isocyanate is taken up rapidly in the blood. This uptake is much higher in normal animals than in those breathing through a tracheal tube.

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安全信息

  • 危险品标志

    Xi

  • WGK Germany

    3

  • 危险品运输编号

    2480

  • 海关编码

    2929109000

  • RTECS号

    NQ9450000

  • 包装等级

    III

  • 危险类别

    6.1(a)

  • 安全说明
    S45;S27/28;S63;S26;S36/37/39;S28;S27
  • 危险类别码
    R63;R42/43;R24/25;R26;R12;R37/38;R41

SDS

提供商 修订日期 查看
Matrix Scientific 2014-06-13 点击查看