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85729-63-1,MFCD00449672
Catalog No.:AA004YIF

85729-63-1 | 3-Oxo-n-(1-phenylethyl)butanamide

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:
AA004YIF
Chemical Name:
3-Oxo-n-(1-phenylethyl)butanamide
CAS Number:
85729-63-1
Molecular Formula:
C12H15NO2
Molecular Weight:
205.2530
MDL Number:
MFCD00449672
SMILES:
CC(c1ccccc1)NC(=O)CC(=O)C
NSC Number:
59843
Properties
Computed Properties
 
Complexity:
232  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
1  
XLogP3:
1.3  

Literature
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SDS
Tags:85729-63-1 Molecular Formula|85729-63-1 MDL|85729-63-1 SMILES|85729-63-1 3-Oxo-n-(1-phenylethyl)butanamide