Home Boronic acids 3-Amino-4-Bromophenylboronic acid, HCl

3-Amino-4-Bromophenylboronic acid, HCl

CAS No.:
2096339-36-3
Catalog Number:
AG01EHJD
Molecular Formula:
C6H8BBrClNO2
Molecular Weight:
252.3012
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$375
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Product Description
Catalog Number:
AG01EHJD
Chemical Name:
3-Amino-4-Bromophenylboronic acid, HCl
CAS Number:
2096339-36-3
Molecular Formula:
C6H8BBrClNO2
Molecular Weight:
252.3012
MDL Number:
MFCD22205749
IUPAC Name:
(3-amino-4-bromophenyl)boronic acid;hydrochloride
InChI:
InChI=1S/C6H7BBrNO2.ClH/c8-5-2-1-4(7(10)11)3-6(5)9;/h1-3,10-11H,9H2;1H
InChI Key:
XSFJIXANNRLRAR-UHFFFAOYSA-N
SMILES:
OB(c1ccc(c(c1)N)Br)O.Cl
Properties
Complexity:
136  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.952g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
252.299g/mol
Monoisotopic Mass:
250.952g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties