Home Boronic acids 3-Butoxy-4-chlorophenylboronic acid

3-Butoxy-4-chlorophenylboronic acid

CAS No.:
1256346-36-7
Catalog Number:
AG000O2C
Molecular Formula:
C10H14BClO3
Molecular Weight:
228.4804
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$100
- +
5g
95%
In Stock USA
United States
$300
- +
10g
95%
In Stock USA
United States
$525
- +
Product Description
Catalog Number:
AG000O2C
Chemical Name:
3-Butoxy-4-chlorophenylboronic acid
CAS Number:
1256346-36-7
Molecular Formula:
C10H14BClO3
Molecular Weight:
228.4804
MDL Number:
MFCD16660284
IUPAC Name:
(3-butoxy-4-chlorophenyl)boronic acid
InChI:
InChI=1S/C10H14BClO3/c1-2-3-6-15-10-7-8(11(13)14)4-5-9(10)12/h4-5,7,13-14H,2-3,6H2,1H3
InChI Key:
CCCPSNXXLWLQHQ-UHFFFAOYSA-N
SMILES:
CCCCOc1cc(ccc1Cl)B(O)O
Properties
Complexity:
180  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.072g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
228.479g/mol
Monoisotopic Mass:
228.072g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties