Home Boronic acids Phenyl-d5-boronic acid

Phenyl-d5-boronic acid

CAS No.:
215527-70-1
Catalog Number:
AG0037UC
Molecular Formula:
C6H2BD5O2
Molecular Weight:
126.9604
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
1 week
United States
$94
- +
1g
98%
1 week
United States
$149
- +
Product Description
Catalog Number:
AG0037UC
Chemical Name:
Phenyl-d5-boronic acid
CAS Number:
215527-70-1
Molecular Formula:
C6H2BD5O2
Molecular Weight:
126.9604
MDL Number:
MFCD02093711
IUPAC Name:
(2,3,4,5,6-pentadeuteriophenyl)boronic acid
InChI:
InChI=1S/C6H7BO2/c8-7(9)6-4-2-1-3-5-6/h1-5,8-9H/i1D,2D,3D,4D,5D
InChI Key:
HXITXNWTGFUOAU-RALIUCGRSA-N
SMILES:
OB(c1c([2H])c([2H])c(c(c1[2H])[2H])[2H])O
Properties
Complexity:
79.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
127.085g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
5  
Molecular Weight:
126.961g/mol
Monoisotopic Mass:
127.085g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties