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Home Deuterated Building Blocks 4426-83-9
4426-83-9,MFCD00041138
Catalog No.:AA003QSE

4426-83-9 | HEPTYL ISOTHIOCYANATE

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
98%
in stock  
$23.00   $16.00
- +
25g
98%
in stock  
$45.00   $32.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003QSE
Chemical Name:
HEPTYL ISOTHIOCYANATE
CAS Number:
4426-83-9
Molecular Formula:
C8H15NS
Molecular Weight:
157.2764
MDL Number:
MFCD00041138
SMILES:
CCCCCCCN=C=S
Properties
Properties
 
BP:
235 °C  
Form:
Liquid  
Refractive Index:
1.4905-1.4925  
Stability:
Moisture Sensitive  

Computed Properties
 
Complexity:
106  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
6  
XLogP3:
4.5  

Downstream Synthesis Route

[1]Stoutlandetal.[JournalofOrganicChemistry,1959,vol.24,p.818]

[1]Bernsteinetal.[JournaloftheAmericanChemicalSociety,1951,vol.73,p.906,908]

[2]Wiles,D.M.;Suprunchuk,T.[CanadianJournalofChemistry,1968,vol.46,p.1865-1871]

[3]Coburn;Glennon;Chmielewicz[JournalofMedicinalChemistry,1974,vol.17,#9,p.1025-1027]

[1]Bradsheretal.[JournalofOrganicChemistry,1958,vol.23,p.618]

[1]Stoutlandetal.[JournalofOrganicChemistry,1959,vol.24,p.818]

[1]Ottman,G.;Hooks,H.[JournalofOrganicChemistry,1966,vol.31,p.838-841]

Literature
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Additional Info:
SDS
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Tags:4426-83-9 Molecular Formula|4426-83-9 MDL|4426-83-9 SMILES|4426-83-9 HEPTYL ISOTHIOCYANATE