7099-91-4,MFCD00963514
Catalog No.:AA00FFAR

7099-91-4 | 3-Hydroxy-1-p-tolylpropane-1,2-dione

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$94.00   $66.00
- +
250mg
95%
in stock  
$157.00   $110.00
- +
1g
90%
in stock  
$400.00   $280.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00FFAR
Chemical Name:
3-Hydroxy-1-p-tolylpropane-1,2-dione
CAS Number:
7099-91-4
Molecular Formula:
C9H8O4
Molecular Weight:
180.1574
MDL Number:
MFCD00963514
SMILES:
COc1ccc(cc1)C(=O)C(=O)O
Properties
Computed Properties
 
Complexity:
204  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.3  

Literature

Title: Synthesis of 3-hydroxy-6-oxo[1,2,4]triazin-1-yl alaninamides, a new class of cyclic dipeptidyl ureas.

Journal: The Journal of organic chemistry 20060609

Title: alpha-Ketocarboxylic acid-based inhibitors of protein tyrosine phosphatases.

Journal: Bioorganic & medicinal chemistry letters 20010723

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SDS
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Tags:7099-91-4 Molecular Formula|7099-91-4 MDL|7099-91-4 SMILES|7099-91-4 3-Hydroxy-1-p-tolylpropane-1,2-dione
Catalog No.: AA00FFAR
7099-91-4,MFCD00963514
7099-91-4 | 3-Hydroxy-1-p-tolylpropane-1,2-dione
Pack Size: 100mg
Purity: 95%
in stock
$94.00 $66.00
Pack Size: 250mg
Purity: 95%
in stock
$157.00 $110.00
Pack Size: 1g
Purity: 90%
in stock
$400.00 $280.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00FFAR
Chemical Name: 3-Hydroxy-1-p-tolylpropane-1,2-dione
CAS Number: 7099-91-4
Molecular Formula: C9H8O4
Molecular Weight: 180.1574
MDL Number: MFCD00963514
SMILES: COc1ccc(cc1)C(=O)C(=O)O
Properties
Complexity: 204  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 13  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.3  
Literature fold

Title: Synthesis of 3-hydroxy-6-oxo[1,2,4]triazin-1-yl alaninamides, a new class of cyclic dipeptidyl ureas.

Journal: The Journal of organic chemistry20060609

Title: alpha-Ketocarboxylic acid-based inhibitors of protein tyrosine phosphatases.

Journal: Bioorganic & medicinal chemistry letters20010723

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