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6590-93-8,MFCD00041072
Catalog No.:AA003IJ6

6590-93-8 | 3,5-DICHLOROPHENYL ISOTHIOCYANATE

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$207.00   $145.00
- +
5g
98%
in stock  
$575.00   $403.00
- +
25g
98%
in stock  
$1,856.00   $1,299.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003IJ6
Chemical Name:
3,5-DICHLOROPHENYL ISOTHIOCYANATE
CAS Number:
6590-93-8
Molecular Formula:
C7H3Cl2NS
Molecular Weight:
204.0764
MDL Number:
MFCD00041072
SMILES:
S=C=Nc1cc(Cl)cc(c1)Cl
Properties
Properties
 
BP:
274 °C(lit.)  
Form:
Solid  
MP:
47-50 °C(lit.)  
Refractive Index:
1.6300 (estimate)  
Stability:
Moisture Sensitive  
Storage:
-20 ℃;  

Computed Properties
 
Complexity:
169  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
1  
XLogP3:
4.6  

Downstream Synthesis Route

[1]Patent:US2015/307453,2015,A1.Locationinpatent:Paragraph0221

[2]JournaloftheChemicalSociety,1926,p.3043

[3]EuropeanJournalofMedicinalChemistry,1990,vol.25,p.81-85

[4]ChemicalandPharmaceuticalBulletin,1996,vol.44,p.2042-2050

[5]BioorganicandMedicinalChemistryLetters,1998,vol.8,p.3397-3402

[6]BioorganicandMedicinalChemistryLetters,2007,vol.17,p.28-33

[1]Tetrahedron,2010,vol.66,p.9912-9924

[2]JournaloftheChemicalSociety,1926,p.3043

[3]JournalofMedicinalChemistry,2015,vol.58,p.1123-1139

1851-09-8    6590-93-8    74-88-4   
2-(4-chlorophenylsulfonyl)-3-(3,5-dichlorophenylamino)-3-methylsulfanylacrylonitrile 

[1]Tagmose,TinaM.;Zaragoza,Florencio;Boonen,HarrieC.M.;Worsaae,Anne;Mogensen,JohnP.;Nielsen,FlemmingE.;Jensen,AnetteFrost;Hansen,JohnBondo[BioorganicandMedicinalChemistry,2003,vol.11,#6,p.931-940]

[2]CurrentPatentAssignee:NOVONORDISKA/S-US2001/25111,2001,A1

498-62-4    6590-93-8    171778-06-6   
2-2-(3,5-dichloro-phenylamino)-3-thiophen-3-ylmethyl-3,4-dihydro-quinazolin-4-yl-acetamide 

[1]Song,Aimin;Mařík,Jan;Lam,KitS.[TetrahedronLetters,2004,vol.45,#13,p.2727-2730]

154590-66-6    6590-93-8   
<i>N</i>-(3-{4-4-(3,5-dichloro-phenylthiocarbamoyl)-piperazin-1-yl-3-fluoro-phenyl}-2-oxo-oxazolidin-5-ylmethyl)-acetamide 

[1]ChemicalandPharmaceuticalBulletin,2007,vol.55,p.236-240

Literature

Title: The factors that influence the elution order for the resolution of amino acids on vancomycin phase using the polar-organic mobile phases after their pre-column derivatization with electrophilic reagents.

Journal: Biomedical chromatography : BMC 20050701

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