6,6,12,12-tetrafluoro-2,8-diphenylindeno[1,2-b]fluorene

C32H18F4 — CID 102323887

IUPAC6,6,12,12-tetrafluoro-2,8-diphenylindeno[1,2-b]fluorene
SMILESFC1(F)c2cc(-c3ccccc3)ccc2-c2cc3c(cc21)-c1ccc(-c2ccccc2)cc1C3(F)F
InChIInChI=1S/C32H18F4/c33-31(34)27-15-21(19-7-3-1-4-8-19)11-13-23(27)25-17-30-26(18-29(25)31)24-14-12-22(16-28(24)32(30,35)36)20-9-5-2-6-10-20/h1-18H
InChIKeyMLPAGBUHSYELCT-UHFFFAOYSA-N
MW478.49 g/mol
LogP9.26
Rot. Bonds2

About 6,6,12,12-tetrafluoro-2,8-diphenylindeno[1,2-b]fluorene

6,6,12,12-tetrafluoro-2,8-diphenylindeno[1,2-b]fluorene (PubChem CID 102323887) has the molecular formula C32H18F4 and a molecular weight of 478.49 g/mol. Its IUPAC name is 6,6,12,12-tetrafluoro-2,8-diphenylindeno[1,2-b]fluorene.

Molecular Properties

Compound Name6,6,12,12-tetrafluoro-2,8-diphenylindeno[1,2-b]fluorene
PubChem CID102323887
Molecular FormulaC32H18F4
Molecular Weight478.49 g/mol
Exact Mass478.13
IUPAC Name6,6,12,12-tetrafluoro-2,8-diphenylindeno[1,2-b]fluorene
SMILESFC1(F)c2cc(-c3ccccc3)ccc2-c2cc3c(cc21)-c1ccc(-c2ccccc2)cc1C3(F)F
InChIInChI=1S/C32H18F4/c33-31(34)27-15-21(19-7-3-1-4-8-19)11-13-23(27)25-17-30-26(18-29(25)31)24-14-12-22(16-28(24)32(30,35)36)20-9-5-2-6-10-20/h1-18H
InChIKeyMLPAGBUHSYELCT-UHFFFAOYSA-N
XLogP9.26
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500478.49
LogP ≤ 59.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

Indeno(1,2,3-cd)pyrene
CID 9131
Dibenzo(a,e)fluoranthene
CID 21480
Indeno(1,2,3-hi)chrysene
CID 130669
Rubicene
CID 67454
Indeno[1,2,3-fg]naphthacene
CID 164559
Decacyclene
CID 67448
Pentaphenylbenzene
CID 313988
Diindeno(1,2,3-cd:1',2',3'-lm)perylene
CID 96712
9,9'-Bifluorene
CID 137063
9-Fluorobenzo(k)fluoranthene
CID 135850
Hexaphenylbenzene
CID 70432
9H-Fluorene, 9-(9H-fluoren-9-ylidene)-
CID 136564

Frequently Asked Questions

What is the IUPAC name of 6,6,12,12-tetrafluoro-2,8-diphenylindeno[1,2-b]fluorene?
The IUPAC name of 6,6,12,12-tetrafluoro-2,8-diphenylindeno[1,2-b]fluorene (CID 102323887) is 6,6,12,12-tetrafluoro-2,8-diphenylindeno[1,2-b]fluorene.
What is the SMILES notation for 6,6,12,12-tetrafluoro-2,8-diphenylindeno[1,2-b]fluorene?
The canonical SMILES for 6,6,12,12-tetrafluoro-2,8-diphenylindeno[1,2-b]fluorene is FC1(F)c2cc(-c3ccccc3)ccc2-c2cc3c(cc21)-c1ccc(-c2ccccc2)cc1C3(F)F.
What is the InChIKey of 6,6,12,12-tetrafluoro-2,8-diphenylindeno[1,2-b]fluorene?
The InChIKey is MLPAGBUHSYELCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H18F4/c33-31(34)27-15-21(19-7-3-1-4-8-19)11-13-23(27)25-17-30-26(18-29(25)31)24-14-12-22(16-28(24)32(30,35)36)20-9-5-2-6-10-20/h1-18H.
What are the key properties of 6,6,12,12-tetrafluoro-2,8-diphenylindeno[1,2-b]fluorene?
6,6,12,12-tetrafluoro-2,8-diphenylindeno[1,2-b]fluorene has a molecular weight of 478.49 g/mol, XLogP of 9.26, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6,6,12,12-tetrafluoro-2,8-diphenylindeno[1,2-b]fluorene is sourced from PubChem (CID 102323887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).