Home Boronic Acids 870778-95-3
870778-95-3,MFCD07369741
Catalog No.:AA003IQG
870778-95-3 | 3-Acetyl-2-fluorophenylboronic acid
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$29.00   $20.00
- +
5g
98%
in stock  
$86.00   $60.00
- +
25g
98%
in stock  
$258.00   $180.00
- +
100g
98%
in stock  
$762.00   $534.00
  • Technical Information
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Technical Information
Catalog Number:
AA003IQG
Chemical Name:
3-Acetyl-2-fluorophenylboronic acid
CAS Number:
870778-95-3
Molecular Formula:
C8H8BFO3
Molecular Weight:
181.9567
MDL Number:
MFCD07369741
IUPAC Name:
(3-acetyl-2-fluorophenyl)boronic acid
InChI:
InChI=1S/C8H8BFO3/c1-5(11)6-3-2-4-7(8(6)10)9(12)13/h2-4,12-13H,1H3
InChI Key:
SEMRLZGDJZRZMC-UHFFFAOYSA-N
SMILES:
OB(c1cccc(c1F)C(=O)C)O
Properties
Computed Properties
 
Complexity:
198  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.055g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
181.957g/mol
Monoisotopic Mass:
182.055g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Synonyms
 
3-Acetyl-2-fluorophenylboronic acid 
870778-95-3 
AKOS015837536 
ZINC169877257 
AB32202 
FCH1119785 
RTR-027136 
PC412214 
AX8261417 
X2564 
A-3651 
I04-1983 
(3-Acetyl-2-fluorophenyl)boronic acid 
C8H8BFO3 
ACMC-209qe8 
SCHEMBL1066809 
CTK5F7746 
DTXSID30584641 
SEMRLZGDJZRZMC-UHFFFAOYSA-N 
ANW-38478 
MFCD07369741 
Literature
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