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Home Amines 587-48-4
587-48-4,MFCD00013983
Catalog No.:AA00E9GH

587-48-4 | 3-Acetylaminobenzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%(HPLC)
in stock  
$24.00   $17.00
- +
5g
98%(HPLC)
in stock  
$48.00   $34.00
- +
25g
>99.0%(T)(HPLC)
in stock  
$58.00   $40.00
- +
100g
98%
in stock  
$170.00   $119.00
- +
500g
98%
in stock  
$643.00   $450.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA00E9GH
Chemical Name:
3-Acetylaminobenzoic acid
CAS Number:
587-48-4
Molecular Formula:
C9H9NO3
Molecular Weight:
179.1727
MDL Number:
MFCD00013983
SMILES:
CC(=O)Nc1cccc(c1)C(=O)O
NSC Number:
4001
Properties
Properties
 
BP:
444.1 °C at 760 mmHg  
Form:
Solid  
MP:
247-252 °C  
Refractive Index:
1.5600 (estimate)  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
215  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
2  
XLogP3:
1.3  

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

Title: Design and synthesis of benzoic acid derivatives as influenza neuraminidase inhibitors using structure-based drug design.

Journal: Journal of medicinal chemistry 19971205

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Additional Info:
SDS
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