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Home Boronic acids 3-Butoxy-4-chloro-2-fluorophenylboronic acid

3-Butoxy-4-chloro-2-fluorophenylboronic acid

CAS No.:
1256346-25-4
Catalog Number:
AG000O1A
Molecular Formula:
C10H13BClFO3
Molecular Weight:
246.4708
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$450
- +
10g
98%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG000O1A
Chemical Name:
3-Butoxy-4-chloro-2-fluorophenylboronic acid
CAS Number:
1256346-25-4
Molecular Formula:
C10H13BClFO3
Molecular Weight:
246.4708
MDL Number:
MFCD17015740
IUPAC Name:
(3-butoxy-4-chloro-2-fluorophenyl)boronic acid
InChI:
InChI=1S/C10H13BClFO3/c1-2-3-6-16-10-8(12)5-4-7(9(10)13)11(14)15/h4-5,14-15H,2-3,6H2,1H3
InChI Key:
DTPPHPUEQJHYOL-UHFFFAOYSA-N
SMILES:
CCCCOc1c(Cl)ccc(c1F)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