Home Boronic acids 1,4-Benzenediboronic acid bis(neopentyl glycol) ester

1,4-Benzenediboronic acid bis(neopentyl glycol) ester

CAS No.:
5565-36-6
Catalog Number:
AG003DM9
Molecular Formula:
C16H24B2O4
Molecular Weight:
301.9814
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
99%(GC)
In Stock USA
United States
$107
- +
1g
99%(GC)
In Stock USA
United States
$279
- +
5g
99%(GC)
In Stock USA
United States
$936
- +
Product Description
Catalog Number:
AG003DM9
Chemical Name:
1,4-Benzenediboronic acid bis(neopentyl glycol) ester
CAS Number:
5565-36-6
Molecular Formula:
C16H24B2O4
Molecular Weight:
301.9814
MDL Number:
MFCD01075726
IUPAC Name:
2-[4-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)phenyl]-5,5-dimethyl-1,3,2-dioxaborinane
InChI:
InChI=1S/C16H24B2O4/c1-15(2)9-19-17(20-10-15)13-5-7-14(8-6-13)18-21-11-16(3,4)12-22-18/h5-8H,9-12H2,1-4H3
InChI Key:
XDODHEZHZCJSML-UHFFFAOYSA-N
SMILES:
CC1(C)COB(OC1)c1ccc(cc1)B1OCC(CO1)(C)C
Properties
Complexity:
324  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.186g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
301.984g/mol
Monoisotopic Mass:
302.186g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
36.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties