17608-09-2

Basic information

• Product Name: 2-METHOXYBENZYL ISOTHIOCYANATE
• Synonyms: 2-METHOXYBENZYL ISOTHIOCYANATE;1-(Isothiocyanatomethyl)-2-methoxybenzene;2-Methoxybenzyl isothiocyanate, 95+%;2-Methoxybenzyl isothiocyate, 98%
• CAS NO: 17608-09-2
• Molecular Formula: C₉H₉NOS
• Molecular Weight: 179.24
• Mol File: 17608-09-2.mol
• Article Data: 5

Chemical Properties

• Melting Point: 28 °C
• Boiling Point: 133 °C
• Flash Point: 122.2 °C
• Appearance: /
• Density: 1.06 g/cm³
• Vapor Pressure: 0.00722mmHg at 25°C
• Refractive Index: 1.544
• CAS DataBase Reference: 2-METHOXYBENZYL ISOTHIOCYANATE(CAS DataBase Reference)
• NIST Chemistry Reference: 2-METHOXYBENZYL ISOTHIOCYANATE(17608-09-2)
• EPA Substance Registry System: 2-METHOXYBENZYL ISOTHIOCYANATE(17608-09-2)

Safety Data

• Statements: 20/21/22-36/37/38
• Safety Statements: 26-36/37/39
• RIDADR: 2810
• HazardClass: IRRITANT-HARMFUL
• Hazardous Substances Data: 17608-09-2(Hazardous Substances Data)

Usage

General Description

2-Methoxybenzyl isothiocyanate is a chemical compound with the formula C9H9NOS and a molecular weight of 179.23 g/mol. It belongs to the family of benzyl isothiocyanates and is derived from the naturally occurring compound sinigrin, found in cruciferous vegetables such as mustard, horseradish, and cress. 2-Methoxybenzyl isothiocyanate has shown potential anticancer properties, specifically against human leukemia cells, by inducing apoptosis and inhibiting cell growth. Additionally, it has demonstrated antioxidant and anti-inflammatory activities, making it a promising compound for further research and potential therapeutic applications.

InChI:InChI=1/C9H9NOS/c1-11-9-5-3-2-4-8(9)6-10-7-12/h2-5H,6H2,1H3

Upstream product

• 333-20-0 potassium thioacyanate 
• 7035-02-1 o-Methoxybenzyl chloride 
• 75-15-0 carbon disulfide 
• 6850-57-3 2-methoxybenzylamine 
• 463-71-8 thiophosgene 

Downstream Products

• 883022-05-7 C₁₁H₁₆N₂O₂S 
• 612-16-8 (2-methoxyphenyl)methanol 
• 1531635-61-6 (±)-{4-chloro-2-[5-(2-methoxy-benzylthiocarbamoyl)-4,5,6,7-tetrahydro-thiazolo[5,4-c]pyridin-4-yl]-phenoxy}-acetic acid 
• 1384521-61-2 O-(2-methyl-4-oxo-3,4-dihydroquinazolin-6-yl)methyl-2-methoxybenzylcarbamothioate 
• 6850-57-3 2-methoxybenzylamine 
• 66892-30-6 1-(2-methoxybenzyl)thiourea 

Relevant articles and documents

Synthesis and cytotoxic evaluation of quinazolin-4(3H)-one derivatives bearing thiocarbamate, thiourea or N-methyldithiocarbamate side Chains

We have previously found that the dithiocarbamate derivatives of quinazolin-4(3H)-one could act as cytotoxic agents against a panel of human tumor cell lines. To investigate the contribution of dithiocarbamate moiety to the cytotoxic activity, three series of novel quinazolin-4(3H)-one derivatives bearing thiocarbamate, thiourea or Nmethyldithiocarbamate side chains were synthesized and tested for their cytotoxic activity against human cancer cell lines A549, MCF-7, HeLa, HT29 and HCT-116 by MTT assay. The results showed that transformation of the dithiocarbamate moiety in lead compound I to thiocarbamate or thiourea led to a decrease or loss of cytotoxic activity. Some N-alkylated analogs of lead compound II preferentially inhibited the proliferation of A549 cells, although their potencies were not improved in comparison with the unalkylated counterparts. The structure-activity relationship obtained in this research will be beneficial for further synthesis and discovery of effective cytotoxic agents.

Selective Alpha 2B/2C Agonists

Described herein are compounds useful as agonists of alpha 2B/2C receptors. Pharmaceutical compositions including the presently described compounds and methods of treatment of diseases and conditions with the presently described compounds also are disclos

2-IMINO-1,3-THIAZINE DERIVATIVES

A compound of the formula (I) of the present invention selectively binds to a cannabinoid type 2 receptor (CB2R) and exhibits an antagonistic activity or agonistic activity to CB2R. wherein R1 is optionally substituted alkylene; R2 i