Home Boronic acids 4-(3-Methylphenoxy)phenylboronic acid

4-(3-Methylphenoxy)phenylboronic acid

CAS No.:
1029438-39-8
Catalog Number:
AG00H9VU
Molecular Formula:
C13H13BO3
Molecular Weight:
228.0515
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$550
- +
Product Description
Catalog Number:
AG00H9VU
Chemical Name:
4-(3-Methylphenoxy)phenylboronic acid
CAS Number:
1029438-39-8
Molecular Formula:
C13H13BO3
Molecular Weight:
228.0515
MDL Number:
MFCD28024838
IUPAC Name:
[4-(3-methylphenoxy)phenyl]boronic acid
InChI:
InChI=1S/C13H13BO3/c1-10-3-2-4-13(9-10)17-12-7-5-11(6-8-12)14(15)16/h2-9,15-16H,1H3
InChI Key:
BICYMQDGXNOCML-UHFFFAOYSA-N
SMILES:
Cc1cccc(c1)Oc1ccc(cc1)B(O)O
Properties
Complexity:
227  
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:
3  
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties