(9-Oxo-9H-xanthene-2,7-diyl)diboronic Acid - CAS 2133447-57-9
Catalog: |
BB016774 |
Product Name: |
(9-Oxo-9H-xanthene-2,7-diyl)diboronic Acid |
CAS: |
2133447-57-9 |
Synonyms: |
(7-borono-9-oxo-2-xanthenyl)boronic acid; (7-borono-9-oxoxanthen-2-yl)boronic acid |
IUPAC Name: | (7-borono-9-oxoxanthen-2-yl)boronic acid |
Description: | (9-Oxo-9H-xanthene-2,7-diyl)diboronic Acid (CAS# 2133447-57-9 ) is a useful research chemical. |
Molecular Weight: | 283.84 |
Molecular Formula: | C13H10O6B2 |
Canonical SMILES: | B(C1=CC2=C(C=C1)OC3=C(C2=O)C=C(C=C3)B(O)O)(O)O |
InChI: | InChI=1S/C13H10B2O6/c16-13-9-5-7(14(17)18)1-3-11(9)21-12-4-2-8(15(19)20)6-10(12)13/h1-6,17-20H |
InChI Key: | BTBQHQWIRFDQSD-UHFFFAOYSA-N |
Complexity: | 370 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 284.0663484 |
Formal Charge: | 0 |
Heavy Atom Count: | 21 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 4 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 284.0663484 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 107 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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