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Home > Boronic Acids > 711026-06-1
711026-06-1 | 2,2'-(9,9-Didecyl-9H-fluorene-2,7-diyl)bis[4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CAS No: 711026-06-1 Catalog No: AG00FC5O MDL No:MFCD20275090
Product Description
Catalog Number:
AG00FC5O
Chemical Name:
2,2'-(9,9-Didecyl-9H-fluorene-2,7-diyl)bis[4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CAS Number:
711026-06-1
Molecular Formula:
C45H72B2O4
Molecular Weight:
698.6728
MDL Number:
MFCD20275090
IUPAC Name:
2-[9,9-didecyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)fluoren-2-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C45H72B2O4/c1-11-13-15-17-19-21-23-25-31-45(32-26-24-22-20-18-16-14-12-2)39-33-35(46-48-41(3,4)42(5,6)49-46)27-29-37(39)38-30-28-36(34-40(38)45)47-50-43(7,8)44(9,10)51-47/h27-30,33-34H,11-26,31-32H2,1-10H3
InChI Key:
AGCVTNPCAYFDNL-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCC1(CCCCCCCCCC)c2cc(ccc2c2c1cc(cc2)B1OC(C(O1)(C)C)(C)C)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
943
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
698.562g/mol
Formal Charge:
0
Heavy Atom Count:
51
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
698.687g/mol
Monoisotopic Mass:
698.562g/mol
Rotatable Bond Count:
20
Topological Polar Surface Area:
36.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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