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25774-02-1,MFCD00051723
Catalog No.:AA003TN2

25774-02-1 | Monobenzyl phenylmalonate

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5g
>97.0%(T)
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$409.00   $287.00
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  • Technical Information
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Technical Information
Catalog Number:
AA003TN2
Chemical Name:
Monobenzyl phenylmalonate
CAS Number:
25774-02-1
Molecular Formula:
C16H14O4
Molecular Weight:
270.2800
MDL Number:
MFCD00051723
SMILES:
OC(=O)C(c1ccccc1)C(=O)OCc1ccccc1
Properties
Properties
 
Form:
Solid  
MP:
64-66°C  

Computed Properties
 
Complexity:
327  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
6  
Undefined Atom Stereocenter Count:
1  
XLogP3:
3  

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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Tags:25774-02-1 Molecular Formula|25774-02-1 MDL|25774-02-1 SMILES|25774-02-1 Monobenzyl phenylmalonate