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Home Bromides 1503-53-3
1503-53-3,MFCD00464942
Catalog No.:AA001MEV

1503-53-3 | 2-Acetoxy-5-bromobenzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
92%
in stock  
$150.00   $105.00
- +
1g
92%
in stock  
$329.00   $230.00
- +
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  • Technical Information
  • Properties
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Technical Information
Catalog Number:
AA001MEV
Chemical Name:
2-Acetoxy-5-bromobenzoic acid
CAS Number:
1503-53-3
Molecular Formula:
C9H7BrO4
Molecular Weight:
259.0535
MDL Number:
MFCD00464942
SMILES:
CC(=O)Oc1ccc(cc1C(=O)O)Br
NSC Number:
2400
Properties
Computed Properties
 
Complexity:
241  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
1.9  

Literature

Title: Inactivation of ovine cyclooxygenase-1 by bromoaspirin and aspirin: a quantum chemistry description.

Journal: The journal of physical chemistry. B 20120315

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Tags:1503-53-3 Molecular Formula|1503-53-3 MDL|1503-53-3 SMILES|1503-53-3 2-Acetoxy-5-bromobenzoic acid