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85109-44-0,MFCD00456661
Catalog No.:AA004RBB

85109-44-0 | 3-Isothiocyanatotetrahydrothiophene 1,1-dioxide

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$81.00   $57.00
- +
5g
95%
in stock  
$321.00   $225.00
- +
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Technical Information
Catalog Number:
AA004RBB
Chemical Name:
3-Isothiocyanatotetrahydrothiophene 1,1-dioxide
CAS Number:
85109-44-0
Molecular Formula:
C5H7NO2S2
Molecular Weight:
177.2446
MDL Number:
MFCD00456661
SMILES:
S=C=NC1CCS(=O)(=O)C1
Properties
Computed Properties
 
Complexity:
258  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
1  
XLogP3:
1.1  

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SDS
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Tags:85109-44-0 Molecular Formula|85109-44-0 MDL|85109-44-0 SMILES|85109-44-0 3-Isothiocyanatotetrahydrothiophene 1,1-dioxide