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Merck

252492

Sigma-Aldrich

异硫氰酸苯甲酯

98%

别名:

异硫代氰氧基甲基苯, 苄芥子油

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About This Item

线性分子式:
C6H5CH2NCS
CAS号:
分子量:
149.21
Beilstein:
386135
EC號碼:
MDL號碼:
分類程式碼代碼:
12352100
PubChem物質ID:
NACRES:
NA.22

化驗

98%

形狀

liquid

折射率

n20/D 1.601 (lit.)

bp

242-243 °C (lit.)

密度

1.125 g/mL at 25 °C (lit.)

官能基

amine

儲存溫度

2-8°C

SMILES 字串

S=C=NCc1ccccc1

InChI

1S/C8H7NS/c10-7-9-6-8-4-2-1-3-5-8/h1-5H,6H2

InChI 密鑰

MDKCFLQDBWCQCV-UHFFFAOYSA-N

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一般說明

异硫氰酸苄酯是十字花科蔬菜中的一种天然成分 。它具有抗菌属性,在人体内的代谢已有研究 。它在动物模型中抑制化学诱导的癌症

應用

异硫氰酸苄酯可用作合成以下物质的反应物:
  • 与各种胺反应合成的N

  • -苄基硫脲。
  • 以长链醇处理合成的N-苄基-O-烷基氨基甲酸酯
  • 通过与甲酰肼反应形成酰氨基硫脲中间体合成的3-巯基-1,2,4-三唑结构单元。
  • S -( N -苄基硫代氨基甲酰)-L-谷胱甘肽和 S -( N -苄基硫代氨基甲酰)-L-半胱氨酸

异硫氰酸苄酯用于制备 S -( N -苄基硫代氨基甲酰)-L-谷胱甘肽和 S -( N -苄基硫代氨基甲酰)-L-半胱氨酸

象形圖

Health hazardExclamation mark

訊號詞

Danger

危險分類

Acute Tox. 4 Oral - Eye Irrit. 2 - Resp. Sens. 1 - Skin Irrit. 2 - Skin Sens. 1 - STOT SE 3

標靶器官

Respiratory system

儲存類別代碼

10 - Combustible liquids

水污染物質分類(WGK)

WGK 3

閃點(°F)

222.8 °F

閃點(°C)

106 °C

個人防護裝備

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter


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