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401892-82-8,MFCD03788520
Catalog No.:AA00BZEB

401892-82-8 | 3-(Pentafluorothio)benzonitrile

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
97%
1 week  
$790.00   $553.00
- +
5g
97%
1 week  
$2,135.00   $1,494.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00BZEB
Chemical Name:
3-(Pentafluorothio)benzonitrile
CAS Number:
401892-82-8
Molecular Formula:
C7H4F5NS
Molecular Weight:
229.1704
MDL Number:
MFCD03788520
SMILES:
N#Cc1cccc(c1)S(F)(F)(F)(F)F
Properties
Computed Properties
 
Complexity:
285  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
0  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
4.9  

Literature
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SDS
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Tags:401892-82-8 Molecular Formula|401892-82-8 MDL|401892-82-8 SMILES|401892-82-8 3-(Pentafluorothio)benzonitrile
Catalog No.: AA00BZEB
401892-82-8,MFCD03788520
401892-82-8 | 3-(Pentafluorothio)benzonitrile
Pack Size： 1g
Purity： 97%
1 week
$790.00 $553.00
Pack Size： 5g
Purity： 97%
1 week
$2,135.00 $1,494.00
Quantity
- +
Add to Card
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bulk Quotation Request
Technical Information
Catalog Number: AA00BZEB
Chemical Name: 3-(Pentafluorothio)benzonitrile
CAS Number: 401892-82-8
Molecular Formula: C7H4F5NS
Molecular Weight: 229.1704
MDL Number: MFCD03788520
SMILES: N#Cc1cccc(c1)S(F)(F)(F)(F)F
Properties
Complexity: 285  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 14  
Hydrogen Bond Acceptor Count: 6  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 0  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 4.9  
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