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30742-05-3,MFCD00100658
Catalog No.:AA00311R

30742-05-3 | 4-Oxo-4-(4-(pentyloxy)phenyl)butanoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
25mg
97%
in stock  
$93.00   $65.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00311R
Chemical Name:
4-Oxo-4-(4-(pentyloxy)phenyl)butanoic acid
CAS Number:
30742-05-3
Molecular Formula:
C15H20O4
Molecular Weight:
264.3169
MDL Number:
MFCD00100658
SMILES:
CCCCCOc1ccc(cc1)C(=O)CCC(=O)O
Properties
Computed Properties
 
Complexity:
280  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
9  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
3.2  

Literature

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

Journal: Bioorganic & medicinal chemistry letters 20101101

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SDS
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Tags:30742-05-3 Molecular Formula|30742-05-3 MDL|30742-05-3 SMILES|30742-05-3 4-Oxo-4-(4-(pentyloxy)phenyl)butanoic acid
Catalog No.: AA00311R
30742-05-3,MFCD00100658
30742-05-3 | 4-Oxo-4-(4-(pentyloxy)phenyl)butanoic acid
Pack Size： 25mg
Purity： 97%
in stock
$93.00 $65.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00311R
Chemical Name: 4-Oxo-4-(4-(pentyloxy)phenyl)butanoic acid
CAS Number: 30742-05-3
Molecular Formula: C15H20O4
Molecular Weight: 264.3169
MDL Number: MFCD00100658
SMILES: CCCCCOc1ccc(cc1)C(=O)CCC(=O)O
Properties
Complexity: 280  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 19  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 9  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 3.2  
Literature fold

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

Journal: Bioorganic & medicinal chemistry letters20101101

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