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Home Imidazoles 94084-75-0
94084-75-0,MFCD09736739
Catalog No.:AA00IHUU

94084-75-0 | 4-(1H-Imidazol-1-ylmethyl)benzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
97%
in stock  
$22.00   $15.00
- +
1g
95%
in stock  
$62.00   $44.00
- +
5g
95%
in stock  
$261.00   $183.00
- +
10g
95%
in stock  
$411.00   $288.00
- +
25g
95%
in stock  
$809.00   $567.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00IHUU
Chemical Name:
4-(1H-Imidazol-1-ylmethyl)benzoic acid
CAS Number:
94084-75-0
Molecular Formula:
C11H10N2O2
Molecular Weight:
202.2093
MDL Number:
MFCD09736739
SMILES:
C1=CC(=CC=C1CN2C=CN=C2)C(=O)O
Properties
Computed Properties
 
Complexity:
225  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
1.1  

Downstream Synthesis Route

[1]EuropeanJournalofMedicinalChemistry,1992,vol.27,p.219-228

[1]JournalofMedicinalChemistry,1987,vol.30,p.1342-1347

[1]EuropeanJournalofMedicinalChemistry,1992,vol.27,p.219-228

4-Imidazol-1-ylmethyl-benzoylchloride 
  94084-75-0 

[1]JournalofMedicinalChemistry,1987,vol.30,p.1342-1347

[1]BioorganicandMedicinalChemistryLetters,2003,vol.13,p.719-722

Literature

Title: A structure-permeability study of small drug-like molecules.

Journal: Bioorganic & medicinal chemistry letters 20030224

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SDS
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Tags:94084-75-0 Molecular Formula|94084-75-0 MDL|94084-75-0 SMILES|94084-75-0 4-(1H-Imidazol-1-ylmethyl)benzoic acid