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6095-82-5,MFCD00022055
Catalog No.:AA003FL3

6095-82-5 | 2,4,6-TRIMETHYLPHENYL ISOTHIOCYANATE

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
97%
in stock  
$47.00   $33.00
- +
5g
>98.0%(GC)
in stock  
$95.00   $67.00
- +
25g
97%
in stock  
$141.00   $99.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003FL3
Chemical Name:
2,4,6-TRIMETHYLPHENYL ISOTHIOCYANATE
CAS Number:
6095-82-5
Molecular Formula:
C10H11NS
Molecular Weight:
177.2660
MDL Number:
MFCD00022055
SMILES:
S=C=Nc1c(C)cc(cc1C)C
Properties
Properties
 
BP:
286.3°C at 760 mmHg  
Form:
Solid  
MP:
63-64℃  
Storage:
Inert atmosphere;Room Temperature;  

Computed Properties
 
Complexity:
184  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
1  
XLogP3:
4.4  

Downstream Synthesis Route

[1]Dyson;George[JournaloftheChemicalSociety,1924,vol.125,p.1704]Dyson;Hunter[JournaloftheSocietyofChemicalIndustry,1926,vol.45,p.84T][ChemischesZentralblatt,1926,vol.97,#I,p.3139]

[2]Beck,JamesP.;Curry,MattA.;Chorvat,RobertJ.;Fitzgerald,LarryW.;Gilligan,PaulJ.;Zaczek,Robert;Trainor,GeorgeL.[BioorganicandMedicinalChemistryLetters,1999,vol.9,#8,p.1185-1188]

[1]Yang,Dan;Chen,Ying-Chun;Zhu,Nian-Yong[OrganicLetters,2004,vol.6,#10,p.1577-1580]

[2]Eisenberg[ChemischeBerichte,1882,vol.15,p.1018]

[1]Reiter,Jozsef;Pongo,Laszlo;Dvortsak,Peter[JournalofHeterocyclicChemistry,1987,vol.24,p.1685-1696]

75-89-8    333-20-0   
(2,4,6-trimethylphenyl)diazoniumtetrafluoronorate 
  392-69-8    55757-31-8    6095-82-5    43067-41-0   
2,4,6-trimethylphenyl2,2,2-trifluoroethylether 

[1]Szele,Ivanka;Zollinger,Heinrich;Deshpande,AshokD.[HelveticaChimicaActa,1981,vol.64,#8,p.2721-2727]

[1]Kim,JaeNyoung;Ryu,EungK.[TetrahedronLetters,1993,vol.34,#51,p.8283-8284]

Literature
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SDS
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Tags:6095-82-5 Molecular Formula|6095-82-5 MDL|6095-82-5 SMILES|6095-82-5 2,4,6-TRIMETHYLPHENYL ISOTHIOCYANATE |Organic_Building_Blocks