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W401404

Sigma-Aldrich

异硫氰酸2-苯乙酯

FG

别名:

异硫氰酸苯乙酯, 2-苯基乙基异硫代氰酸酯

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About This Item

线性分子式:
C6H5CH2CH2NCS
CAS号:
2257-09-2
分子量:
163.24
FEMA编号:
4014
Beilstein:
2084162
EC 号:
218-855-5
MDL编号:
MFCD00004821
UNSPSC代码:
12164502
PubChem化学物质编号:
24901970
Flavis编号:
12.193
NACRES:
NA.21

生物来源

synthetic

质量水平

400

等级

FG
Fragrance grade
Halal
Kosher

Agency

follows IFRA guidelines

管理合规性

EU Regulation 1223/2009
EU Regulation 1334/2008 & 178/2002

折射率

n20/D 1.5888 (lit.)

沸点

139-140 °C/11 mmHg (lit.)

密度

1.094 g/mL at 25 °C (lit.)

应用

flavors and fragrances

文件

see Safety & Documentation for available documents

食品过敏原

no known allergens

致敏芳香化合物

no known allergens

性状检查

green; sulfurous

SMILES字符串

S=C=NCCc1ccccc1

InChI

1S/C9H9NS/c11-8-10-7-6-9-4-2-1-3-5-9/h1-5H,6-7H2

InChI key

IZJDOKYDEWTZSO-UHFFFAOYSA-N

基因信息

human ... CYP1A2(1544)

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相关类别

一般描述

2-苯乙基异硫氰酸盐 (2-PE ITC) 是一种生物活性异硫氰酸盐，主要存在于芸薹属蔬菜中。它是通过酶促水解2-苯基乙基芥子油酸酯而制得的。2-PE ITC 是芸薹属根组织对Pratylenchus neglectus Filipjev（一种根部病变线虫）具有杀线虫作用的主要化合物。这一能力使其有望成为开发土壤熏蒸剂的候选产品。

象形图

Health hazardExclamation mark
GHS08,GHS07

警示用语：

Danger

危险分类

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

靶器官

Respiratory system

储存分类代码

10 - Combustible liquids

WGK

WGK 3

闪点(°F)

235.4 °F - closed cup

闪点(°C)

113 °C - closed cup

个人防护装备

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

历史批次信息供参考:

分析证书(COA)

Lot/Batch Number
SHBR4827
SHBS2563
SHBR3067
SHBP1791
SHBP6847

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