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Home Carboxes 18158-16-2
18158-16-2,MFCD03426387
Catalog No.:AA00APGO

18158-16-2 | 5-Oxo-[1,4]diazepane-1-carboxylic acid benzyl ester

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$79.00   $55.00
- +
5g
98%
in stock  
$278.00   $195.00
- +
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Technical Information
Catalog Number:
AA00APGO
Chemical Name:
5-Oxo-[1,4]diazepane-1-carboxylic acid benzyl ester
CAS Number:
18158-16-2
Molecular Formula:
C13H16N2O3
Molecular Weight:
248.2777
MDL Number:
MFCD03426387
SMILES:
O=C1NCCN(CC1)C(=O)OCc1ccccc1
Properties
Computed Properties
 
Complexity:
301  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
0.6  

Literature
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Additional Info:
SDS
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Tags:18158-16-2 Molecular Formula|18158-16-2 MDL|18158-16-2 SMILES|18158-16-2 5-Oxo-[1,4]diazepane-1-carboxylic acid benzyl ester