Home Boronic acids 3-Bromo-4-methylphenylboronic acid

3-Bromo-4-methylphenylboronic acid

CAS No.:
1312765-69-7
Catalog Number:
AG000VU2
Molecular Formula:
C7H8BBrO2
Molecular Weight:
214.8522
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$450
- +
Product Description
Catalog Number:
AG000VU2
Chemical Name:
3-Bromo-4-methylphenylboronic acid
CAS Number:
1312765-69-7
Molecular Formula:
C7H8BBrO2
Molecular Weight:
214.8522
MDL Number:
MFCD16295252
IUPAC Name:
(3-bromo-4-methylphenyl)boronic acid
InChI:
InChI=1S/C7H8BBrO2/c1-5-2-3-6(8(10)11)4-7(5)9/h2-4,10-11H,1H3
InChI Key:
VBESRPDPCSIDEN-UHFFFAOYSA-N
SMILES:
OB(c1ccc(c(c1)Br)C)O
Properties
Complexity:
132  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.98g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
214.853g/mol
Monoisotopic Mass:
213.98g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties