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27091-70-9,MFCD01314999
Catalog No.:AA00IND0
27091-70-9 | N-acetyl-3-oxobutanamide
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
>90%
3 weeks  
$150.00
- +
5mg
>90%
3 weeks  
$162.00
- +
10mg
>90%
3 weeks  
$185.00
- +
500mg
>90%
3 weeks  
$610.00
- +
1g
>90%
3 weeks  
$1,120.00
- +
5g
>90%
3 weeks  
$4,179.00
- +
  • Technical Information
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA00IND0
Chemical Name:
N-acetyl-3-oxobutanamide
CAS Number:
27091-70-9
Molecular Formula:
C6H9NO3
Molecular Weight:
143.1406
MDL Number:
MFCD01314999
IUPAC Name:
N-acetyl-3-oxobutanamide
InChI:
InChI=1S/C6H9NO3/c1-4(8)3-6(10)7-5(2)9/h3H2,1-2H3,(H,7,9,10)
InChI Key:
IZOZBUJRWPPEBT-UHFFFAOYSA-N
SMILES:
CC(=O)CC(=O)NC(=O)C
Properties
Computed Properties
 
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
143.058g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
143.142g/mol
Monoisotopic Mass:
143.058g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
63.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8  

Synonyms
 
N-acetyl-3-oxobutanamide 
27091-70-9 
11M-717 
ZINC01386441 
CID1474640 
N-acetyl acetoacetamide 
AC1LT11V 
SCHEMBL7162568 
KS-00001S0A 
ZINC1386441 
MFCD01314999 
AKOS006279807 
MCULE-5043942110 
Literature
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