Home Boronic acids 3-Bromo-5-propoxyphenylboronic acid, pinacol ester

3-Bromo-5-propoxyphenylboronic acid, pinacol ester

CAS No.:
1218790-36-3
Catalog Number:
AG00168R
Molecular Formula:
C15H22BBrO3
Molecular Weight:
341.0484
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$75
- +
5g
97%
In Stock USA
United States
$225
- +
Product Description
Catalog Number:
AG00168R
Chemical Name:
3-Bromo-5-propoxyphenylboronic acid, pinacol ester
CAS Number:
1218790-36-3
Molecular Formula:
C15H22BBrO3
Molecular Weight:
341.0484
MDL Number:
MFCD12546585
IUPAC Name:
2-(3-bromo-5-propoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C15H22BBrO3/c1-6-7-18-13-9-11(8-12(17)10-13)16-19-14(2,3)15(4,5)20-16/h8-10H,6-7H2,1-5H3
InChI Key:
LRPWJRKNTVJVHO-UHFFFAOYSA-N
SMILES:
CCCOc1cc(Br)cc(c1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
319  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
340.085g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
341.052g/mol
Monoisotopic Mass:
340.085g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties