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Home Fluorides 395-33-5
395-33-5,MFCD00044402
Catalog No.:AA003LCR

395-33-5 | 4-Fluoromandelic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
97%
in stock  
$7.00   $5.00
- +
5g
97%
in stock  
$16.00   $11.00
- +
25g
97%
in stock  
$48.00   $34.00
- +
100g
97%
in stock  
$178.00   $125.00
- +
  • Technical Information
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  • Literature
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003LCR
Chemical Name:
4-Fluoromandelic acid
CAS Number:
395-33-5
Molecular Formula:
C8H7FO3
Molecular Weight:
170.1378
MDL Number:
MFCD00044402
SMILES:
OC(c1ccc(cc1)F)C(=O)O
NSC Number:
73990
Properties
Properties
 
BP:
322.4°C at 760 mmHg  
Form:
Solid  
MP:
136-137°C  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
164  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
1  
XLogP3:
0.7  

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: The metabolic disposition of aprepitant, a substance P receptor antagonist, in rats and dogs.

Journal: Drug metabolism and disposition: the biological fate of chemicals 20040201

Title: Discrimination in resolving systems. VI. Comparison of the diastereomers of deoxyephedrinium and ephedrinium 4'-fluoromandelates.

Journal: Chirality 20010515

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SDS
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Tags:395-33-5 Molecular Formula|395-33-5 MDL|395-33-5 SMILES|395-33-5 4-Fluoromandelic acid |Fluorinated_Building_Blocks