Home Amines 1025530-23-7
1025530-23-7,MFCD00955501
Catalog No.:AA00IX4R

1025530-23-7 | 4,4-dimethyl-3-oxo-2-[(phenylamino)(sulfanyl)methylidene]pentanenitrile

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
>97%
1 week  
$299.00   $209.00
- +
5mg
>97%
1 week  
$319.00   $223.00
- +
10mg
>97%
1 week  
$358.00   $250.00
- +
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Technical Information
Catalog Number:
AA00IX4R
Chemical Name:
4,4-dimethyl-3-oxo-2-[(phenylamino)(sulfanyl)methylidene]pentanenitrile
CAS Number:
1025530-23-7
Molecular Formula:
C14H16N2OS
Molecular Weight:
260.3546
MDL Number:
MFCD00955501
SMILES:
N#CC(=C(Nc1ccccc1)S)C(=O)C(C)(C)C
Properties
Computed Properties
 
Complexity:
392  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
3  
Undefined Bond Stereocenter Count:
1  
XLogP3:
3.7  

Literature
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Additional Info:
SDS
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Tags:1025530-23-7 Molecular Formula|1025530-23-7 MDL|1025530-23-7 SMILES|1025530-23-7 4,4-dimethyl-3-oxo-2-[(phenylamino)(sulfanyl)methylidene]pentanenitrile