Home Other Building Blocks 53782-63-1
53782-63-1,MFCD03032492
Catalog No.:AA00DABI

53782-63-1 | 4-(5-Methyl-2-furyl)benzoic acid

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Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$81.00   $57.00
- +
5g
95%
in stock  
$321.00   $225.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00DABI
Chemical Name:
4-(5-Methyl-2-furyl)benzoic acid
CAS Number:
53782-63-1
Molecular Formula:
C12H10O3
Molecular Weight:
202.2060
MDL Number:
MFCD03032492
SMILES:
OC(=O)c1ccc(cc1)c1ccc(o1)C
Properties
Computed Properties
 
Complexity:
231  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
2.6  

Downstream Synthesis Route

[1]Kathman,StefanG.;Xu,Ziyang;Statsyuk,AlexanderV.[JournalofMedicinalChemistry,2014,vol.57,#11,p.4969-4974]

53782-63-1    139200-39-8   
C17H17NO4 

[1]Kathman,StefanG.;Xu,Ziyang;Statsyuk,AlexanderV.[JournalofMedicinalChemistry,2014,vol.57,#11,p.4969-4974]

53782-63-1   
C10H17NO4*C2HF3O2 
 
C17H17NO4 

[1]McShan,Danielle;Kathman,Stefan;Lowe,Brittiney;Xu,Ziyang;Zhan,Jennifer;Statsyuk,Alexander;Ogungbe,IfedayoVictor[BioorganicandMedicinalChemistryLetters,2015,vol.25,#20,p.4509-4512]

Literature
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SDS
Tags:53782-63-1 Molecular Formula|53782-63-1 MDL|53782-63-1 SMILES|53782-63-1 4-(5-Methyl-2-furyl)benzoic acid |Heterocyclic_Building_Blocks