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3-(Methylthio)propyl isothiocyanate

  • CAS：505-79-3
  • purity：99%
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Reputable factory supply 3-(Methylthio)propyl isothiocyanate 505-79-3 in stock with high standard

  • Molecular Formula:C5H9 N S2
  • Molecular Weight:147.265
  • Appearance/Colour:colorless to yellow clear liquid 
  • Vapor Pressure:0.0451mmHg at 25°C 
  • Refractive Index:n20/D 1.564(lit.) 
  • Boiling Point:245.4 °C at 760 mmHg 
  • Flash Point:110 ºC 
  • PSA：69.75000 
  • Density:1.102 
  • LogP:1.84230 

3-(Methylthio)propyl isothiocyanate(Cas 505-79-3) Usage

Preparation

From 3-methylthiopropylamine and CSCl2.

Aroma threshold values

Detection: 5 ppb. Aroma characteristics at 0.1%: musty, radish, rooty, metallic, vegetative, sulfurous cabbage, horseradish with green mustard nuances

Taste threshold values

Taste characteristics at 5 ppm: rooty radish, sulfurous, earthy vegetative and metallic, horseradish with a methional nuance

InChI:InChI=1/C5H9NS2/c1-8-4-2-3-6-5-7/h2-4H2,1H3

505-79-3 Relevant articles

Structure-Activity Relationship Study on Isothiocyanates: Comparison of TRPA1-Activating Ability between Allyl Isothiocyanate and Specific Flavor Components of Wasabi, Horseradish, and White Mustard

Terada, Yuko,Masuda, Hideki,Watanabe, Tatsuo

, p. 1937 - 1941 (2015/09/08)

Allyl isothiocyanate (ITC) (4) is the ma...

Analysis and anti- helicobacter activity of sulforaphane and related compounds present in Broccoli (Brassica oleracea L.) sprouts

Moon, Joon-Kwan,Kim, Jun-Ran,Ahn, Young-Joon,Shibamoto, Takayuki

experimental part, p. 6672 - 6677 (2011/08/06)

A crude methanol extract prepared from f...

BIOTRANSFORMATION OF ORGANIC SULFIDES. PART 7. FORMATION OF CHIRAL ISOTHIOCYANATO SULFOXIDES AND RELATED COMPOUNDS BY MICROBIAL BIOTRANSFORMATION

Holland, Herbert L.,Brown, Frances M.,Larsen, Brett G.,Zabic, Mirjana

, p. 1569 - 1574 (2007/10/02)

The fungi Helminthosporium species NRRL ...

505-79-3 Process route

thiophosgene
463-71-8

thiophosgene

3-methylthio-1-propanamine
4104-45-4

3-methylthio-1-propanamine

iberverin
505-79-3

iberverin

Conditions
Conditions Yield
With sodium hydroxide; In chloroform; at 20 ℃; for 1h;
72%
With sodium hydroxide; chloroform;
With chloroform; sodium hydrogencarbonate;
3-(methylthio)propyl thiocyanate
86702-84-3

3-(methylthio)propyl thiocyanate

iberverin
505-79-3

iberverin

Conditions
Conditions Yield
With tetrabutylammomium bromide; N,N-dimethyl-formamide; In water; for 1h; Reflux;
32.9 g

505-79-3 Upstream products

  • 463-71-8
    463-71-8

    thiophosgene

  • 4104-45-4
    4104-45-4

    3-methylthio-1-propanamine

  • 86702-84-3
    86702-84-3

    3-(methylthio)propyl thiocyanate

505-79-3 Downstream products

  • 505-44-2
    505-44-2

    iberin

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