5426-11-9,MFCD00245013
Catalog No.:AA01DEDO

5426-11-9 | 2-isobutyryl-1H-indene-1,3(2H)-dione

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
>90%
1 week  
$299.00   $209.00
- +
5mg
>90%
1 week  
$319.00   $223.00
- +
10mg
>90%
1 week  
$358.00   $250.00
- +
  • Technical Information
  • Properties
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Technical Information
Catalog Number:
AA01DEDO
Chemical Name:
2-isobutyryl-1H-indene-1,3(2H)-dione
CAS Number:
5426-11-9
Molecular Formula:
C13H12O3
Molecular Weight:
216.2326
MDL Number:
MFCD00245013
SMILES:
CC(C)C(=O)C1C(=O)C2=CC=CC=C2C1=O
NSC Number:
14010
Properties
Computed Properties
 
Complexity:
319  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.4  

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Tags:5426-11-9 Molecular Formula|5426-11-9 MDL|5426-11-9 SMILES|5426-11-9 2-isobutyryl-1H-indene-1,3(2H)-dione
Catalog No.: AA01DEDO
5426-11-9,MFCD00245013
5426-11-9 | 2-isobutyryl-1H-indene-1,3(2H)-dione
Pack Size: 1mg
Purity: >90%
1 week
$299.00 $209.00
Pack Size: 5mg
Purity: >90%
1 week
$319.00 $223.00
Pack Size: 10mg
Purity: >90%
1 week
$358.00 $250.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA01DEDO
Chemical Name: 2-isobutyryl-1H-indene-1,3(2H)-dione
CAS Number: 5426-11-9
Molecular Formula: C13H12O3
Molecular Weight: 216.2326
MDL Number: MFCD00245013
SMILES: CC(C)C(=O)C1C(=O)C2=CC=CC=C2C1=O
NSC Number: 14010
Properties
Complexity: 319  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 16  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.4  
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