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Structure

9 9-Dioctylfluorene-2 7-diboronic acid

CAS
258865-48-4
Catalog Number
ACM258865484
Category
Other Products
Molecular Weight
478.3g/mol
Molecular Formula
C29H44B2O4

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Specification

IUPAC Name
(7-borono-9,9-dioctylfluoren-2-yl)boronic acid
Canonical SMILES
B(C1=CC2=C(C=C1)C3=C(C2(CCCCCCCC)CCCCCCCC)C=C(C=C3)B(O)O)(O)O
InChI
InChI=1S/C29H44B2O4/c1-3-5-7-9-11-13-19-29(20-14-12-10-8-6-4-2)27-21-23(30(32)33)15-17-25(27)26-18-16-24(31(34)35)22-28(26)29/h15-18,21-22,32-35H,3-14,19-20H2,1-2H3
InChI Key
HURJMQMZDPOUOU-UHFFFAOYSA-N
Complexity
537
Covalently-Bonded Unit Count
1
Exact Mass
478.34257g/mol
Formal Charge
0
H-Bond Acceptor
4
H-Bond Donor
4
Heavy Atom Count
35
Monoisotopic Mass
478.34257g/mol
Rotatable Bond Count
16

Upstream Synthesis Route 1

  • 198964-46-4
  • 258865-48-4

Reference: [1]Location in patent: experimental part
Zhu, Haifeng; Tong, Hui; Gong, Yongyang; Shao, Shiyang; Deng, Chunmei; Yuan, Wang Zhang; Zhang, Yongming
[Journal of Polymer Science, Part A: Polymer Chemistry, 2012, vol. 50, # 11, p. 2172 - 2181]

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