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Home Boronic acids 3-Chloro-4-ethoxy-5-fluorophenylboronic acid

3-Chloro-4-ethoxy-5-fluorophenylboronic acid

CAS No.:
2096334-30-2
Catalog Number:
AG01EHNW
Molecular Formula:
C8H9BClFO3
Molecular Weight:
218.4177
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$225
- +
5g
98%
In Stock USA
United States
$675
- +
Product Description
Catalog Number:
AG01EHNW
Chemical Name:
3-Chloro-4-ethoxy-5-fluorophenylboronic acid
CAS Number:
2096334-30-2
Molecular Formula:
C8H9BClFO3
Molecular Weight:
218.4177
MDL Number:
MFCD20441841
IUPAC Name:
(3-chloro-4-ethoxy-5-fluorophenyl)boronic acid
InChI:
InChI=1S/C8H9BClFO3/c1-2-14-8-6(10)3-5(9(12)13)4-7(8)11/h3-4,12-13H,2H2,1H3
InChI Key:
AAPPGBQQZJDSBE-UHFFFAOYSA-N
SMILES:
CCOc1c(F)cc(cc1Cl)B(O)O
Properties
Complexity:
184  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.032g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
218.415g/mol
Monoisotopic Mass:
218.032g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties