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104968-58-3

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104968-58-3 Usage

General Description

3,5-Dimethoxyphenyl isothiocyanate is a chemical compound with the molecular formula C10H9NO2S. It is a derivative of isothiocyanate, which is a functional group containing a sulfur atom bonded to an isocyanate group. 3,5-Dimethoxyphenyl isothiocyanate is a yellowish solid that is used in organic synthesis and as a building block for the preparation of various bioactive compounds. It has been studied for its potential antimicrobial and anticancer properties, as well as its ability to modify proteins and peptides. 3,5-DIMETHOXYPHENYL ISOTHIOCYANATE is also known for its strong, unpleasant odor and should be handled with caution due to its potential irritant properties.

Check Digit Verification of cas no

The CAS Registry Mumber 104968-58-3 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,0,4,9,6 and 8 respectively; the second part has 2 digits, 5 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 104968-58:
(8*1)+(7*0)+(6*4)+(5*9)+(4*6)+(3*8)+(2*5)+(1*8)=143
143 % 10 = 3
So 104968-58-3 is a valid CAS Registry Number.
InChI:InChI=1/C9H9NO2S/c1-11-8-3-7(10-6-13)4-9(5-8)12-2/h3-5H,1-2H3

104968-58-3 Well-known Company Product Price

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  • Alfa Aesar

  • (A15728)  3,5-Dimethoxyphenyl isothiocyanate, 97%   

  • 104968-58-3

  • 1g

  • 821.0CNY

  • Detail
  • Alfa Aesar

  • (A15728)  3,5-Dimethoxyphenyl isothiocyanate, 97%   

  • 104968-58-3

  • 5g

  • 3103.0CNY

  • Detail
  • Alfa Aesar

  • (A15728)  3,5-Dimethoxyphenyl isothiocyanate, 97%   

  • 104968-58-3

  • 25g

  • 13783.0CNY

  • Detail

104968-58-3SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 13, 2017

Revision Date: Aug 13, 2017

1.Identification

1.1 GHS Product identifier

Product name 1-isothiocyanato-3,5-dimethoxybenzene

1.2 Other means of identification

Product number -
Other names 3,5-Dimethoxyphenyl isothiocyanate

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:104968-58-3 SDS

104968-58-3Relevant articles and documents

Synthesis of isothiocyanates using DMT/NMM/TsO? as a new desulfurization reagent

Janczewski, ?ukasz,Kolesińska, Beata,Kr?giel, Dorota

, (2021/05/29)

Thirty-three alkyl and aryl isothiocyanates, as well as isothiocyanate derivatives from esters of coded amino acids and from esters of unnatural amino acids (6-aminocaproic, 4-(aminomethyl)benzoic, and tranexamic acids), were synthesized with satisfactory or very good yields (25–97%). Synthesis was performed in a “one-pot”, two-step procedure, in the presence of organic base (Et3 N, DBU or NMM), and carbon disulfide via dithiocarbamates, with 4-(4,6-dimethoxy-1,3,5-triazin-2-yl)-4-methylmorpholinium toluene-4-sulfonate (DMT/NMM/TsO? ) as a desulfurization reagent. For the synthesis of aliphatic and aromatic isothiocyanates, reactions were carried out in a microwave reactor, and selected alkyl isothiocyanates were also synthesized in aqueous medium with high yields (72–96%). Isothiocyanate derivatives of L-and D-amino acid methyl esters were synthesized, under conditions without microwave radiation assistance, with low racemization (er 99 > 1), and their absolute configuration was confirmed by circular dichroism. Isothiocyanate derivatives of natural and unnatural amino acids were evaluated for antibacterial activity on E. coli and S. aureus bacterial strains, where the most active was ITC 9e.

Methyl 3-((6-methoxy-1,4-dihydroindeno[1,2-c]pyrazol-3-yl)amino)benzoate (GN39482) as a tubulin polymerization inhibitor identified by morphobase and chemproteobase profiling methods

Minegishi, Hidemitsu,Futamura, Yushi,Fukashiro, Shinji,Muroi, Makoto,Kawatani, Makoto,Osada, Hiroyuki,Nakamura, Hiroyuki

, p. 4230 - 4241 (2015/06/08)

A series of indenopyrazoles was synthesized from the corresponding indanones and phenyl isothiocyanates in two steps. Among the compounds synthesized, methyl 3-((6-methoxy-1,4-dihydroindeno[1,2-c]pyrazol-3-yl)amino)benzoate 6m (GN39482) was found to posse

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