Home Boronic acids 2-(Hydroxymethyl)-4-(trifluoromethyl)phenylboronic acid

2-(Hydroxymethyl)-4-(trifluoromethyl)phenylboronic acid

CAS No.:
1629148-48-6
Catalog Number:
AG00HYT5
Molecular Formula:
C8H8BF3O3
Molecular Weight:
219.9535
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$156
- +
1g
98%
In Stock USA
United States
$325
- +
5g
98%
In Stock USA
United States
$1225
- +
Product Description
Catalog Number:
AG00HYT5
Chemical Name:
2-(Hydroxymethyl)-4-(trifluoromethyl)phenylboronic acid
CAS Number:
1629148-48-6
Molecular Formula:
C8H8BF3O3
Molecular Weight:
219.9535
MDL Number:
MFCD22574938
IUPAC Name:
[2-(hydroxymethyl)-4-(trifluoromethyl)phenyl]boronic acid
InChI:
InChI=1S/C8H8BF3O3/c10-8(11,12)6-1-2-7(9(14)15)5(3-6)4-13/h1-3,13-15H,4H2
InChI Key:
QJZJYNDNLGOFFZ-UHFFFAOYSA-N
SMILES:
OCc1cc(ccc1B(O)O)C(F)(F)F
Properties
Complexity:
210  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.052g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
219.954g/mol
Monoisotopic Mass:
220.052g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
60.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties