Phenylethyl isothio...

Phenylethyl isothiocyanate  competitive product
Phenylethyl isothiocyanate  competitive product

Phenylethyl isothiocyanate competitive product

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Product Name: Phenylethyl isothiocyanate
Synonyms: 2-Phenylethyl isothiocyanate, Phenethyl isothiocyanate;β-Phenylethyl isothiocyanate, Phenethyl isothiocyanate;Isothiocyanic acid phenethyl;Phenylethyl isothiocyanate,96%;PHENETHYL GLUCOSINOLATE POTASSIUM SALT(GLUCONASTURTIIN)(RG);Isothiocyanic Acid 2-Phenylethyl Ester Phenethyl Isothiocyanate;PHENYLETHYL ISOTHIOCYANATE(P)(REQUEST QUOTE);Phenethyl isothiocyanate 99%
CAS: 2257-09-2
MF: C9H9NS
MW: 163.24
EINECS: 218-855-5
Product Categories: Aromatics Compounds;Aromatics;Sulfur & Selenium Compounds
Mol File: 2257-09-2.mol
Phenylethyl isothiocyanate Structure
 
Phenylethyl isothiocyanate Chemical Properties
Melting point  143~145℃
Boiling point  75 °C0.25 mm Hg
density  1.094 g/mL at 25 °C(lit.)
refractive index  n20/D 1.5888(lit.)
FEMA  4014 | PHENETHYL ISOTHIOCYANATE
Fp  >230 °F
storage temp.  Refrigerator, Under Inert Atmosphere
form  Liquid
Specific Gravity 1.09
color  Clear colorless to yellow
Water Solubility  insoluble
Sensitive  Moisture Sensitive
Merck  14,7226
JECFA Number 1563
BRN  2084162
InChIKey IZJDOKYDEWTZSO-UHFFFAOYSA-N
CAS DataBase Reference 2257-09-2(CAS DataBase Reference)
NIST Chemistry Reference Benzene, (2-isothiocyanatoethyl)-(2257-09-2)
EPA Substance Registry System Benzene, (2-isothiocyanatoethyl)-(2257-09-2)
 
Safety Information
Hazard Codes  Xn
Risk Statements  20/21/22-36/37/38-42-42/43
Safety Statements  23-26-36-36/37
RIDADR  UN 2206 6.1/PG 3
WGK Germany  3
RTECS  NX9115000
10-23
TSCA  Yes
HazardClass  8
PackingGroup  III
HS Code  29309090
Toxicity LD50 in mice (mg/kg): 700 orally; 150 s.c.; 50 i.v. (Lichtenstein)
MSDS Information
Provider Language
SigmaAldrich English
ACROS English
ALFA English
 
Phenylethyl isothiocyanate Usage And Synthesis
Chemical Properties Light Yellow Liquid
Chemical Properties Phenethyl isothiocyanate has a strong green irritating odor.
Uses Flavor ingredient; provides the hot or burning sensation in horseradish.
Definition ChEBI: An isothiocyanate having a phenethyl group attached to the nitrogen. It is a naturally occurring compound found in some cruciferous vegetables (e.g. watercress) and is known to possess anticancer properties.
Preparation Prepared by hydrolysis of gluconasturtiin, an abundant natural product present in cruciferous vegetables.
Anticancer Research PEITC is a naturally occurring isothiocyanate, found mostly in cruciferous vegetablesincluding cauliflower, watercress, cabbage, Brussels sprouts, garden cress, broccoli,and bok choy. It shows chemopreventive and anticancer activity againstmelanoma, breast cancer, myeloma, human liver hepatoma, non-small cell lung cancer,cervical cancer, prostate cancer, and osteogenic sarcoma. It induces apoptosis in some drug resistance cell lines. Its mechanism of action is much diversified in variouscancer cells. It induces apoptosis in highly metastatic human non-small cell lungcancer, L9981 cells via caspase-3 activation, and cell cycle arrest in G2/M phase bymodulation of cyclin B1 expression while targeting MAPK/AP-1 pathway. In cervicalcancer cells, it increases the death receptor (DR4, DR5) expression, cleaves caspase-3, induces caspase-8, truncates BID, and downregulates ERK1/2 and MEKphosphorylation while maintaining the expression of JNK and phospho-p38MAPK. In human prostate cancer (DU 145) cell line, PEITC induces apoptosis byactivating caspase cascade pathway (Wang et al. 2012; Cheung and Kong 2010).

 

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