Home Boronic acids 4-(Phenoxymethyl)phenylboronic acid

4-(Phenoxymethyl)phenylboronic acid

CAS No.:
397843-61-7
Catalog Number:
AG00C8BE
Molecular Formula:
C13H13BO3
Molecular Weight:
228.0515
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$188
- +
5g
98%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG00C8BE
Chemical Name:
4-(Phenoxymethyl)phenylboronic acid
CAS Number:
397843-61-7
Molecular Formula:
C13H13BO3
Molecular Weight:
228.0515
MDL Number:
MFCD09966155
IUPAC Name:
[4-(phenoxymethyl)phenyl]boronic acid
InChI:
InChI=1S/C13H13BO3/c15-14(16)12-8-6-11(7-9-12)10-17-13-4-2-1-3-5-13/h1-9,15-16H,10H2
InChI Key:
IXDHTLPOOZIZJX-UHFFFAOYSA-N
SMILES:
OB(c1ccc(cc1)COc1ccccc1)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:
228.096g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
228.054g/mol
Monoisotopic Mass:
228.096g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties