Home Boronic acids 3-Bromo-5-tert-butylphenylboronic acid

3-Bromo-5-tert-butylphenylboronic acid

CAS No.:
1373881-94-7
Catalog Number:
AG00HUY2
Molecular Formula:
C10H14BBrO2
Molecular Weight:
256.9320
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$100
- +
5g
98%
In Stock USA
United States
$350
- +
25g
98%
In Stock USA
United States
$1225
- +
Product Description
Catalog Number:
AG00HUY2
Chemical Name:
3-Bromo-5-tert-butylphenylboronic acid
CAS Number:
1373881-94-7
Molecular Formula:
C10H14BBrO2
Molecular Weight:
256.9320
MDL Number:
MFCD28167195
IUPAC Name:
(3-bromo-5-tert-butylphenyl)boronic acid
InChI:
InChI=1S/C10H14BBrO2/c1-10(2,3)7-4-8(11(13)14)6-9(12)5-7/h4-6,13-14H,1-3H3
InChI Key:
IYYXDZHRVBGUAG-UHFFFAOYSA-N
SMILES:
Brc1cc(cc(c1)C(C)(C)C)B(O)O
Properties
Complexity:
191  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.027g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
256.934g/mol
Monoisotopic Mass:
256.027g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties