CAS 2257-09-2; (2-异硫氰酸基乙基)苯; β-Phenylethyl isothiocyanate

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货号

品牌

产品名称

规格

包装、参考价格

P815538

MACKLIN

2-苯基乙基异硫代氰酸酯

99%

48元/1g; 166元/5g; 484元/25g; 1303元/100g;

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储存：室温
状态：无色到黄色液体
折射率：n20/D 1.5888(lit.)

P0986

TCI

2-Phenylethyl Isothiocyanate

>97.0%(GC)

790元/10ML;

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基本信息

纯度/分析方法	>97.0%(GC)
分子式/分子量	C₉H₉NS = 163.24
外观与形状(20℃)	液体
储存在惰性气体下	存放于惰性气体之中
应避免的情况	湿气 (分解)
Reaxys-RN	2084162
PubChem物质ID	87575100
SDBS (AIST Spectral DB)	18314
Merck Index (14)	7226
MDL编号	MFCD00004821

技术规格

Appearance	Colorless to Light orange to Yellow clear liquid
Purity(GC)	min. 97.0 %

物性(参考值)

沸点	126 ℃/20 mmHg
比重	1.11
折射率	1.59

安全信息

图形或危害标志
信号词	危险
危险性说明	H302 + H332 : 吞咽或吸入有害。 H314 : 造成严重皮肤灼伤和眼损伤。 H334 : 吸入可能导致过敏或哮喘病症状或呼吸困难。 H400 : 对水生生物毒性极大。
防范说明	P501 : 将内装物/容器送到批准的废物处理厂处理。 P261 : 避免吸入粉尘/烟/气体/烟雾/蒸气/喷雾。 P273 : 避免释放到环境中。 P270 : 使用本产品时不要进食、饮水或吸烟。 P271 : 只能在室外或通风良好之处使用。 P264 : 作业后彻底清洗皮肤。 P280 : 戴防护手套/穿防护服/戴防护眼罩/戴防护面具。 P284 : [在通风不足的情况下]戴呼吸防护装置。 P391 : 收集溢出物。 P342 + P311 : 如有呼吸系统病症：呼叫急救中心/医生。 P303 + P361 + P353 : 如皮肤(或头发)沾染：立即脱掉所有沾污的衣物。用水清洗皮肤/淋浴。 P301 + P330 + P331 : 如误吞咽：漱口。不要诱导呕吐。 P363 : 沾染的衣服清洗后方可重新使用。 P301 + P312 + P330 : 如误吞咽：如感觉不适，呼叫急救中心/医生。漱口。 P304 + P340 + P310 : 如误吸入：将人转移到空气新鲜处，保持呼吸舒适体位。立即呼叫急救中心/医生。 P305 + P351 + P338 + P310 : 如进入眼睛：用水小心冲洗几分钟。如戴隐形眼镜并可方便地取出，取出隐形眼镜。继续冲洗。立即呼叫急救中心/医生。 P405 : 存放处须加锁。

相关法规

RTECS#

NX9115000

运输信息

UN编号	UN1760
类别	8
包装类别	III
监管条件代码(*)

202023

J&K

2-Phenethyl isothiocyanate

96%

346元/5G; 1383元/25G;

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基本信息

分子式	C₉H₉NS
分子量	163.24
沸点	75
闪点	113
密度	1.094
MDL编码	MFCD00004821
Beilstein	2084162
Merck	14,7226
EINECS 编号	218-855-5
存储条件	Store at 2-8℃

安全信息

图形或危害标志
提示语	Danger
危险说明	H302 H312 H315 H317 H319 H331 H334 H335
防范说明	P261 P280 P305+P351+P338 P342+P311
UN号码	2206
危险分类	6.1
包装等级	III
WGK	3
RTECS	NX9115000
TSCA	是

A15123

Alfa Aesar

2-Phenylethyl Isothiocyanate

98%

1399元/5g; 5892元/25g; 20014元/100g;

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应用
Phenethyl isothiocyanate is an NNK-induced lung tumorigenesis inhibitor.

备注
Moisture Sensitive, store away from moisture. Store in cool, dry place in tightly closed container. Store away from oxidizing agent. Store under dry inert gas.

基本信息

MDL
MFCD00004821

EINECS
218-855-5

分子式
C₆H₅(CH₂)₂NCS

分子量
163.24

沸点
139-140°/11mm

闪点
>110°(230°F)

密度
1.090

折射率
1.5888

灵敏度
Moisture Sensitive. Ambient temperatures.

形态
Liquid

溶解性
Soluble in chloroform, ethyl acetate, and dichoromethane. Reacts with water.

Beilstein
2084162

GHS危害和防范说明

GHS符号

Hazard Statements
H302-H312-H331-H314-H318
Harmful if swallowed.Harmful in contact with skin.Toxic if inhaled.Causes severe skin burns and eye damage.Causes serious eye damage.

Precautionary Statements
P260h-P303+P361+P353-P305+P351+P338-P301+P330+P331-P405-P501a
IF ON SKIN (or hair): Remove/Take off immediately all contaminated clothing. Rinse skin with water/shower.IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.IF SWALLOWED: Rinse mouth. Do NOT induce vomiting.Store locked up.Dispose of contents/container in accordance with local/regional/national/international regulations.

安全信息

危险等级
6.1

包装组
III

危险类别
20/21/22-34
Harmful by inhalation, in contact with skin and if swallowed.Causes burns.

安全等级
26-36/37/39-45
In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.Wear suitable protective clothing, gloves and eye/face protection.In case of accident or if you feel unwell, seek medical advice immediately (show the label where possible).

欧盟危险品标志

RTECS
NX9115000

TSCA
是

C26516

Alfa Aesar

Phenylethyl isothiocyanate

96%

1305元/5g; 4291元/25g;

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基本信息

Ref#
26516

MDL
4821

分子式
C9 H9 N S

分子量
163.24

闪点
100

密度
1.1

形态
Liquid

安全信息

危险等级
6.1

包装组
III

253731

Sigma-Aldrich

Phenethyl Isothiocyanate

99%

1048.54元/5 G;

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产品说明

一般描述

异硫氰酸苯乙酯是十字花科蔬菜中天然存在的异硫氰酸苯乙酯。异硫氰酸苯乙酯是一种化学预防剂。在各种人类癌细胞模型中通过阻滞细胞周期、诱导细胞凋亡而抑制癌细胞生长。

包装

5 g in glass bottle

基本信息

线性分子式	C₆H₅CH₂CH₂NCS
分子量	163.24
Beilstein	2084162
EC 号	218-855-5
MDL编号	MFCD00004821
PubChem化学物质编号	24855324
NACRES	NA.22

产品性质

质量水平	100
测定	99%
形式	liquid
折射率	n20/D 1.5888 (lit.)
bp	139-140 ℃/11 mmHg (lit.)
密度	1.094 g/mL at 25 ℃ (lit.)
储存温度	2-8℃
SMILES string	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
Gene Information	human ... CYP1A2(1544)

安全信息

象形图
警示用语：	Danger
危险声明	H302 + H312 + H332 - H315 - H317 - H319 - H334 - H335
预防措施声明	P261 - P264 - P280 - P301 + P312 - P302 + P352 + P312 - P305 + P351 + P338
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	6.1C - Combustible, acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects
WGK	WGK 3
闪点(F)	235.4 °F - closed cup
闪点(C)	113 ℃ - closed cup
个人防护装备	Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

W401404

Sigma-Aldrich

2-Phenylethyl Isothiocyanate

404.65元/; 848.14元/25 G; 1249.67元/100 G; 15146.9元/1 KG;

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产品说明

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。

基本信息

线性分子式	C₆H₅CH₂CH₂NCS
分子量	163.24
FEMA编号	4014
Beilstein	2084162
EC 号	218-855-5
MDL编号	MFCD00004821
PubChem化学物质编号	24901970
Flavis编号	12.193

产品性质

质量水平	400
生物来源	synthetic
等级	FG Halal Kosher
agency	follows IFRA guidelines
reg. compliance	EU Regulation 1223/2009 EU Regulation 1334/2008 & 178/2002
折射率	n20/D 1.5888 (lit.)
bp	139-140 ℃/11 mmHg (lit.)
密度	1.094 g/mL at 25 ℃ (lit.)
文件	see Safety & Documentation for available documents
性状检查	green; sulfurous
application(s)	flavors and fragrances
食品过敏原	no known allergens
致敏芳香化合物	no known allergens
SMILES string	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
Gene Information	human ... CYP1A2(1544)

安全信息

象形图
警示用语：	Danger
危险声明	H302 + H312 + H332 - H315 - H317 - H319 - H334 - H335
预防措施声明	P261 - P264 - P280 - P301 + P312 - P302 + P352 + P312 - P305 + P351 + P338
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 ℃ - closed cup
个人防护装备	Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

009560

Fluorochem

Beta-Phenethylisothiocyanate

99%

220元/1g; 704元/5g; 1100元/10g; 1760元/25g;

咨询

基本信息

CAS Number	2257-09-2
MDL Number	MFCD00004821
Boiling Point	139-140℃/11mm
Density	1.09

安全信息

图形或危害标志
危险性说明	H302: Harmful if swallowed. H314: Causes severe skin burns and eye damage. H317: May cause an allergic skin reaction. H332: Harmful if inhaled. H334: May cause allergy or asthma symptoms or breathing difficulties if inhaled.
防范说明	P260: Do not breathe P261: Avoid breathing P264: Wash hands thoroughly after handling. P270: Do not eat, drink or smoke when using this product. P271: Use only outdoors or in a well-ventilated area. P272: Contaminated work clothing should not be allowed out of the workplace. P280: Wear . P285: In case of inadequate ventilation wear respiratory protection. P301 + P312: IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell. P301 + P330 + P331: IF SWALLOWED: Rinse mouth. Do NOT induce vomiting. P302 + P352: IF ON SKIN: Wash with plenty of soap and water. P303 + P361 + P353: IF ON SKIN (or hair): Remove/Take off immediately all contaminated clothing. Rinse skin with water/shower. P304 + P340: IF INHALED: Remove victim to fresh air and keep at rest in a position comfortable for breathing. P304 + P341: IF INHALED: If breathing is difficult, remove victim to fresh air and keep at rest in a position comfortable for breathing. P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing. P310: Immediately call a POISON CENTER or doctor/physician. P312: Call a POISON CENTER or doctor/physician if you feel unwell. P321: Specific treatment (see . on this label). P330: Rinse mouth. P333 + P313: If skin irritation or rash occurs: Get medical advice/attention. P342 + P311: If experiencing respiratory symptoms: Call a POISON CENTER or doctor/physician. P363: Wash contaminated clothing before reuse. P405: Store locked up. P501: Dispose of contents/container to local regulations.