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Home Boronic acids 4-Aminophenylboronic acid

4-Aminophenylboronic acid

CAS No.:
89415-43-0
Catalog Number:
AG0088R8
Molecular Formula:
C6H8BNO2
Molecular Weight:
136.9442
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$282
- +
5g
98%
In Stock USA
United States
$1125
- +
Product Description
Catalog Number:
AG0088R8
Chemical Name:
4-Aminophenylboronic acid
CAS Number:
89415-43-0
Molecular Formula:
C6H8BNO2
Molecular Weight:
136.9442
MDL Number:
MFCD14636624
IUPAC Name:
(4-aminophenyl)boronic acid
InChI:
InChI=1S/C6H8BNO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4,9-10H,8H2
InChI Key:
MKPDAJWEBQRQCO-UHFFFAOYSA-N
SMILES:
OB(c1ccc(cc1)N)O
Properties
Complexity:
102  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
137.065g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
136.945g/mol
Monoisotopic Mass:
137.065g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
Title Journal
Synthesis of functionalized cinnamaldehyde derivatives by an oxidative Heck reaction and their use as starting materials for preparation of Mycobacterium tuberculosis 1-deoxy-D-xylulose-5-phosphate reductoisomerase inhibitors. The Journal of organic chemistry 20111104
Properties