Home Boronic acids 2-Hydroxymethylphenylboronic acid, dehydrated

2-Hydroxymethylphenylboronic acid, dehydrated

CAS No.:
5735-41-1
Catalog Number:
AG00E9AP
Molecular Formula:
C7H7BO2
Molecular Weight:
133.9403
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$22
- +
5g
98%
In Stock USA
United States
$58
- +
10g
98%
In Stock USA
United States
$105
- +
25g
98%
In Stock USA
United States
$212
- +
100g
98%
In Stock USA
United States
$588
- +
Product Description
Catalog Number:
AG00E9AP
Chemical Name:
2-Hydroxymethylphenylboronic acid, dehydrated
CAS Number:
5735-41-1
Molecular Formula:
C7H7BO2
Molecular Weight:
133.9403
MDL Number:
MFCD01075677
IUPAC Name:
1-hydroxy-3H-2,1-benzoxaborole
InChI:
InChI=1S/C7H7BO2/c9-8-7-4-2-1-3-6(7)5-10-8/h1-4,9H,5H2
InChI Key:
XOQABDOICLHPIS-UHFFFAOYSA-N
SMILES:
OB1OCc2c1cccc2
NSC Number:
719278
Properties
Complexity:
129  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
134.054g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
133.941g/mol
Monoisotopic Mass:
134.054g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
Title Journal
Design, synthesis, and structure-activity relationship of Trypanosoma brucei leucyl-tRNA synthetase inhibitors as antitrypanosomal agents. Journal of medicinal chemistry 20110310
Synthesis and evaluation of 3-(dihydroxyboryl)benzoic acids as D,D-carboxypeptidase R39 inhibitors. Journal of medicinal chemistry 20091008
Discovery of a new boron-containing antifungal agent, 5-fluoro-1,3-dihydro-1-hydroxy-2,1- benzoxaborole (AN2690), for the potential treatment of onychomycosis. Journal of medicinal chemistry 20060727
Properties