9,9-Dihexylfluorene-2,7-diboronic acid

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Catalog Number
ACM203927984-1
Product Name
9,9-Dihexylfluorene-2,7-diboronic acid
Structure
Structure
CAS
203927-98-4
Category
Boronic Acids
IUPAC Name
(7-borono-9,9-dihexylfluoren-2-yl)boronic acid
Molecular Weight
422.2g/mol
Molecular Formula
C25H36B2O4
Canonical SMILES
B(C1=CC2=C(C=C1)C3=C(C2(CCCCCC)CCCCCC)C=C(C=C3)B(O)O)(O)O
InChI
InChI=1S/C25H36B2O4/c1-3-5-7-9-15-25(16-10-8-6-4-2)23-17-19(26(28)29)11-13-21(23)22-14-12-20(27(30)31)18-24(22)25/h11-14,17-18,28-31H,3-10,15-16H2,1-2H3
InChI Key
QFWOJNOZWMHNTK-UHFFFAOYSA-N
Complexity
484
Covalently-Bonded Unit Count
1
Exact Mass
422.27997g/mol
Formal Charge
0
H-Bond Acceptor
4
H-Bond Donor
4
Heavy Atom Count
31
Monoisotopic Mass
422.27997g/mol
Rotatable Bond Count
12
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