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87720-44-3 | [1,3,2]Dioxaborino[5,4-d]-1,3,2-dioxaborin-4,8-dione, 2,6-diethyl-
CAS No: 87720-44-3 Catalog No: AG004N0X MDL No:
Product Description
Catalog Number:
AG004N0X
Chemical Name:
[1,3,2]Dioxaborino[5,4-d]-1,3,2-dioxaborin-4,8-dione, 2,6-diethyl-
CAS Number:
87720-44-3
Molecular Formula:
C8H10B2O6
Molecular Weight:
223.7834
IUPAC Name:
2,6-diethyl-[1,3,2]dioxaborinino[5,4-d][1,3,2]dioxaborinine-4,8-dione
InChI:
InChI=1S/C8H10B2O6/c1-3-9-13-5-6(7(11)15-9)14-10(4-2)16-8(5)12/h3-4H2,1-2H3
InChI Key:
FFYUPPDOYVAVPZ-UHFFFAOYSA-N
SMILES:
CCB1OC(=O)C2=C(O1)C(=O)OB(O2)CC
Properties
Complexity:
332
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.066g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.782g/mol
Monoisotopic Mass:
224.066g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
71.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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