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66053-93-8,MFCD06011067
Catalog No.:AA00FAY7

66053-93-8 | 2-(3,4,5-Trimethyl-1H-pyrazol-1-yl)acetic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$324.00   $227.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00FAY7
Chemical Name:
2-(3,4,5-Trimethyl-1H-pyrazol-1-yl)acetic acid
CAS Number:
66053-93-8
Molecular Formula:
C8H12N2O2
Molecular Weight:
168.1931
MDL Number:
MFCD06011067
SMILES:
OC(=O)Cn1nc(c(c1C)C)C
Properties
Computed Properties
 
Complexity:
184  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.1  

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

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SDS
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Tags:66053-93-8 Molecular Formula|66053-93-8 MDL|66053-93-8 SMILES|66053-93-8 2-(3,4,5-Trimethyl-1H-pyrazol-1-yl)acetic acid
Catalog No.: AA00FAY7
66053-93-8,MFCD06011067
66053-93-8 | 2-(3,4,5-Trimethyl-1H-pyrazol-1-yl)acetic acid
Pack Size： 1g
Purity： 95%
in stock
$324.00 $227.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00FAY7
Chemical Name: 2-(3,4,5-Trimethyl-1H-pyrazol-1-yl)acetic acid
CAS Number: 66053-93-8
Molecular Formula: C8H12N2O2
Molecular Weight: 168.1931
MDL Number: MFCD06011067
SMILES: OC(=O)Cn1nc(c(c1C)C)C
Properties
Complexity: 184  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 12  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.1  
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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