Home Boronic acids 3-Bromo-2-(3'-bromobenzyloxy)-5-methylphenylboronic acid

3-Bromo-2-(3'-bromobenzyloxy)-5-methylphenylboronic acid

CAS No.:
849052-16-0
Catalog Number:
AG003BR1
Molecular Formula:
C14H13BBr2O3
Molecular Weight:
399.8702
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$73
- +
1g
95%
In Stock USA
United States
$225
- +
Product Description
Catalog Number:
AG003BR1
Chemical Name:
3-Bromo-2-(3'-bromobenzyloxy)-5-methylphenylboronic acid
CAS Number:
849052-16-0
Molecular Formula:
C14H13BBr2O3
Molecular Weight:
399.8702
MDL Number:
MFCD06411363
IUPAC Name:
[3-bromo-2-[(3-bromophenyl)methoxy]-5-methylphenyl]boronic acid
InChI:
InChI=1S/C14H13BBr2O3/c1-9-5-12(15(18)19)14(13(17)6-9)20-8-10-3-2-4-11(16)7-10/h2-7,18-19H,8H2,1H3
InChI Key:
VWXCNKUTFMOYDY-UHFFFAOYSA-N
SMILES:
Brc1cccc(c1)COc1c(Br)cc(cc1B(O)O)C
Properties
Complexity:
306  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
399.93g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
399.873g/mol
Monoisotopic Mass:
397.932g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties