Home Other Building Blocks 3968-40-9
3968-40-9,MFCD00159631
Catalog No.:AA00C872

3968-40-9 | 1-(1-Phenyl-1h-pyrazol-4-yl)ethanone

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$128.00   $90.00
- +
5g
95%
in stock  
$361.00   $253.00
- +
10g
95%
in stock  
$560.00   $392.00
- +
25g
95%
in stock  
$1,208.00   $846.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00C872
Chemical Name:
1-(1-Phenyl-1h-pyrazol-4-yl)ethanone
CAS Number:
3968-40-9
Molecular Formula:
C11H10N2O
Molecular Weight:
186.2099
MDL Number:
MFCD00159631
SMILES:
CC(=O)c1cnn(c1)c1ccccc1
Properties
Properties
 
BP:
316°C at 760 mmHg  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
211  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
2  
XLogP3:
1.6  

Downstream Synthesis Route

[1]JournaloftheChemicalSociety,1959,p.1819,1821

[1]JournaloftheChemicalSociety,1959,p.1819,1821

[2]JournaloftheChemicalSociety,1959,p.4015

[1]AngewandteChemie-InternationalEdition,2019,vol.58,p.13318-13322    Angew.Chem.,2019,p.13452-13456,5

Literature
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Additional Info:
SDS
Tags:3968-40-9 Molecular Formula|3968-40-9 MDL|3968-40-9 SMILES|3968-40-9 1-(1-Phenyl-1h-pyrazol-4-yl)ethanone