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Home Boronic acids 4-Butoxy-3-chloro-5-fluorophenylboronic acid

4-Butoxy-3-chloro-5-fluorophenylboronic acid

CAS No.:
2096338-35-9
Catalog Number:
AG01EHOP
Molecular Formula:
C10H13BClFO3
Molecular Weight:
246.4708
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$75
- +
5g
98%
In Stock USA
United States
$225
- +
Product Description
Catalog Number:
AG01EHOP
Chemical Name:
4-Butoxy-3-chloro-5-fluorophenylboronic acid
CAS Number:
2096338-35-9
Molecular Formula:
C10H13BClFO3
Molecular Weight:
246.4708
MDL Number:
MFCD20441805
IUPAC Name:
(4-butoxy-3-chloro-5-fluorophenyl)boronic acid
InChI:
InChI=1S/C10H13BClFO3/c1-2-3-4-16-10-8(12)5-7(11(14)15)6-9(10)13/h5-6,14-15H,2-4H2,1H3
InChI Key:
WWRLALPWGKYOSD-UHFFFAOYSA-N
SMILES:
CCCCOc1c(F)cc(cc1Cl)B(O)O
Properties
Complexity:
209  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.063g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
246.469g/mol
Monoisotopic Mass:
246.063g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties