Home Boronic acids 4-Isopropoxyphenylboronic acid, hydrate

4-Isopropoxyphenylboronic acid, hydrate

CAS No.:
1256355-64-2
Catalog Number:
AG000O59
Molecular Formula:
C9H15BO4
Molecular Weight:
198.0240
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$50
- +
5g
95%
In Stock USA
United States
$150
- +
Product Description
Catalog Number:
AG000O59
Chemical Name:
4-Isopropoxyphenylboronic acid, hydrate
CAS Number:
1256355-64-2
Molecular Formula:
C9H15BO4
Molecular Weight:
198.0240
MDL Number:
MFCD03427051
IUPAC Name:
(4-propan-2-yloxyphenyl)boronic acid;hydrate
InChI:
InChI=1S/C9H13BO3.H2O/c1-7(2)13-9-5-3-8(4-6-9)10(11)12;/h3-7,11-12H,1-2H3;1H2
InChI Key:
ONOFEMDDNLFOFD-UHFFFAOYSA-N
SMILES:
OB(c1ccc(cc1)OC(C)C)O.O
Properties
Complexity:
142  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.106g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
198.025g/mol
Monoisotopic Mass:
198.106g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
50.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties