9,9-Didodecylfluorene-2,7-diboronic acid

Product Information

Molecular Formula:
(OH)2BC6H3C(C12H25)2C6H3B(OH)2
Molecular Weight:
590.49
Description
Reactant involved in synthesis of:• Luminescent alternating boron quinolate-fluorene copolymers• C nanotube composites for polymer memory devices via Suzuki coupling reactions• Fluorine-containing fluorene oligomers
Synonyms
(7-borono-9,9-didodecylfluoren-2-yl)boronic acid; 9 9-DIDODECYLFLUORENE-2 7-DIBORONIC ACID; (9,9-Didodecyl-9H-fluorene-2,7-diyl)diboronic acid; Boronic acid, (9,9-didodecyl-9H-fluorene-2,7-diyl)bis-; 9,9-Didodecylfluorene-2,7-diboronic acid, 97%; A854570; (9,9-Didodecyl-9H-fluorene-2,7-diyl)diboronicacid; 2,7-Bis(dihydroxyboryl)-9,9-didodecyl-9H-fluorene
IUPAC Name
(7-borono-9,9-didodecylfluoren-2-yl)boronic acid
Canonical SMILES
B(C1=CC2=C(C=C1)C3=C(C2(CCCCCCCCCCCC)CCCCCCCCCCCC)C=C(C=C3)B(O)O)(O)O
InChI
InChI=1S/C37H60B2O4/c1-3-5-7-9-11-13-15-17-19-21-27-37(28-22-20-18-16-14-12-10-8-6-4-2)35-29-31(38(40)41)23-25-33(35)34-26-24-32(39(42)43)30-36(34)37/h23-26,29-30,40-43H,3-22,27-28H2,1-2H3
InChI Key
MLGWUNIPUPZNEE-UHFFFAOYSA-N
Melting Point
269 °C (Dec.) (lit.)
Flash Point
Not applicable
Purity
97%

Computed Properties

Hydrogen Bond Donor Count
4
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
24
Exact Mass
590.4677707 g/mol
Monoisotopic Mass
590.4677707 g/mol
Topological Polar Surface Area
80.9Ų
Heavy Atom Count
43
Formal Charge
0
Complexity
646
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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