Home Boronic acids 4-[(2-Isopropyl-5-methylphenoxy)methyl]phenylboronic acid

4-[(2-Isopropyl-5-methylphenoxy)methyl]phenylboronic acid

CAS No.:
1072951-58-6
Catalog Number:
AG007WIA
Molecular Formula:
C17H21BO3
Molecular Weight:
284.1578
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
96%
In Stock USA
United States
$23
- +
1g
96%
In Stock USA
United States
$44
- +
Product Description
Catalog Number:
AG007WIA
Chemical Name:
4-[(2-Isopropyl-5-methylphenoxy)methyl]phenylboronic acid
CAS Number:
1072951-58-6
Molecular Formula:
C17H21BO3
Molecular Weight:
284.1578
MDL Number:
MFCD08276834
IUPAC Name:
[4-[(5-methyl-2-propan-2-ylphenoxy)methyl]phenyl]boronic acid
InChI:
InChI=1S/C17H21BO3/c1-12(2)16-9-4-13(3)10-17(16)21-11-14-5-7-15(8-6-14)18(19)20/h4-10,12,19-20H,11H2,1-3H3
InChI Key:
FBZSTYQOBCWTEC-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(c1)OCc1ccc(cc1)B(O)O)C(C)C
Properties
Complexity:
300  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.158g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
284.162g/mol
Monoisotopic Mass:
284.158g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties