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89-33-8,MFCD00020764
Catalog No.:AA003ZBM

89-33-8 | Ethyl 5-oxo-1-phenyl-4,5-dihydro-1h-pyrazole-3-carboxylate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
25mg
98%
2 weeks  
$50.00   $35.00
- +
100mg
98%
2 weeks  
$86.00   $60.00
- +
250mg
98%
2 weeks  
$128.00   $89.00
- +
1g
98%
2 weeks  
$325.00   $228.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA003ZBM
Chemical Name:
Ethyl 5-oxo-1-phenyl-4,5-dihydro-1h-pyrazole-3-carboxylate
CAS Number:
89-33-8
Molecular Formula:
C12H12N2O3
Molecular Weight:
232.2353
MDL Number:
MFCD00020764
SMILES:
CCOC(=O)C1=NN(C(=O)C1)c1ccccc1
Properties
Properties
 
Form:
Solid  
MP:
181.5-182.5℃  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
346  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.6  

Upstream Synthesis Route

[1]JournalofOrganicChemistry,2017,vol.82,#5,p.2794-2802

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

Quotation Request
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Additional Info:
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SDS
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Tags:89-33-8 Molecular Formula|89-33-8 MDL|89-33-8 SMILES|89-33-8 Ethyl 5-oxo-1-phenyl-4,5-dihydro-1h-pyrazole-3-carboxylate
Catalog No.: AA003ZBM
89-33-8,MFCD00020764
89-33-8 | Ethyl 5-oxo-1-phenyl-4,5-dihydro-1h-pyrazole-3-carboxylate
Pack Size： 25mg
Purity： 98%
2 weeks
$50.00 $35.00
Pack Size： 100mg
Purity： 98%
2 weeks
$86.00 $60.00
Pack Size： 250mg
Purity： 98%
2 weeks
$128.00 $89.00
Pack Size： 1g
Purity： 98%
2 weeks
$325.00 $228.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA003ZBM
Chemical Name: Ethyl 5-oxo-1-phenyl-4,5-dihydro-1h-pyrazole-3-carboxylate
CAS Number: 89-33-8
Molecular Formula: C12H12N2O3
Molecular Weight: 232.2353
MDL Number: MFCD00020764
SMILES: CCOC(=O)C1=NN(C(=O)C1)c1ccccc1
Properties
Form: Solid  
MP: 181.5-182.5℃  
Storage: Keep in dry area;Room Temperature;  
Complexity: 346  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 17  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 4  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.6  
Upstream Synthesis Route
762-21-0    89-33-8 

[1]JournalofOrganicChemistry,2017,vol.82,#5,p.2794-2802

Literature fold

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters20101101

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology20060501

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