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Home Carboxes 55007-22-2
55007-22-2,MFCD00235258
Catalog No.:AA00D9AG

55007-22-2 | 4-(2-Methoxy-5-methylphenyl)-4-oxobutanoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
97%
1 week  
$652.00   $457.00
- +
2g
97%
1 week  
$1,090.00   $763.00
- +
5g
97%
1 week  
$2,484.00   $1,739.00
- +
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Technical Information
Catalog Number:
AA00D9AG
Chemical Name:
4-(2-Methoxy-5-methylphenyl)-4-oxobutanoic acid
CAS Number:
55007-22-2
Molecular Formula:
C12H14O4
Molecular Weight:
222.2372
MDL Number:
MFCD00235258
SMILES:
COc1ccc(cc1C(=O)CCC(=O)O)C
NSC Number:
171278
Properties
Computed Properties
 
Complexity:
262  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
5  
XLogP3:
1.4  

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:55007-22-2 Molecular Formula|55007-22-2 MDL|55007-22-2 SMILES|55007-22-2 4-(2-Methoxy-5-methylphenyl)-4-oxobutanoic acid