7-fluoro-2-(7-fluorobenzo[f][1]benzofuran-2-yl)benzo[f][1]benzofuran

C24H12F2O2 — CID 71108521

IUPAC7-fluoro-2-(7-fluorobenzo[f][1]benzofuran-2-yl)benzo[f][1]benzofuran
SMILESFc1ccc2cc3cc(-c4cc5cc6ccc(F)cc6cc5o4)oc3cc2c1
InChIInChI=1S/C24H12F2O2/c25-19-3-1-13-5-17-11-23(27-21(17)9-15(13)7-19)24-12-18-6-14-2-4-20(26)8-16(14)10-22(18)28-24/h1-12H
InChIKeyLADVCQMERKFWGB-UHFFFAOYSA-N
MW370.35 g/mol
LogP7.43
Rot. Bonds1

About 7-fluoro-2-(7-fluorobenzo[f][1]benzofuran-2-yl)benzo[f][1]benzofuran

7-fluoro-2-(7-fluorobenzo[f][1]benzofuran-2-yl)benzo[f][1]benzofuran (PubChem CID 71108521) has the molecular formula C24H12F2O2 and a molecular weight of 370.35 g/mol. Its IUPAC name is 7-fluoro-2-(7-fluorobenzo[f][1]benzofuran-2-yl)benzo[f][1]benzofuran.

Molecular Properties

Compound Name7-fluoro-2-(7-fluorobenzo[f][1]benzofuran-2-yl)benzo[f][1]benzofuran
PubChem CID71108521
Molecular FormulaC24H12F2O2
Molecular Weight370.35 g/mol
Exact Mass370.08
IUPAC Name7-fluoro-2-(7-fluorobenzo[f][1]benzofuran-2-yl)benzo[f][1]benzofuran
SMILESFc1ccc2cc3cc(-c4cc5cc6ccc(F)cc6cc5o4)oc3cc2c1
InChIInChI=1S/C24H12F2O2/c25-19-3-1-13-5-17-11-23(27-21(17)9-15(13)7-19)24-12-18-6-14-2-4-20(26)8-16(14)10-22(18)28-24/h1-12H
InChIKeyLADVCQMERKFWGB-UHFFFAOYSA-N
XLogP7.43
TPSA26.28 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.35
LogP ≤ 57.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-fluoro-2-(7-fluorobenzo[f][1]benzofuran-2-yl)benzo[f][1]benzofuran?
The IUPAC name of 7-fluoro-2-(7-fluorobenzo[f][1]benzofuran-2-yl)benzo[f][1]benzofuran (CID 71108521) is 7-fluoro-2-(7-fluorobenzo[f][1]benzofuran-2-yl)benzo[f][1]benzofuran.
What is the SMILES notation for 7-fluoro-2-(7-fluorobenzo[f][1]benzofuran-2-yl)benzo[f][1]benzofuran?
The canonical SMILES for 7-fluoro-2-(7-fluorobenzo[f][1]benzofuran-2-yl)benzo[f][1]benzofuran is Fc1ccc2cc3cc(-c4cc5cc6ccc(F)cc6cc5o4)oc3cc2c1.
What is the InChIKey of 7-fluoro-2-(7-fluorobenzo[f][1]benzofuran-2-yl)benzo[f][1]benzofuran?
The InChIKey is LADVCQMERKFWGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H12F2O2/c25-19-3-1-13-5-17-11-23(27-21(17)9-15(13)7-19)24-12-18-6-14-2-4-20(26)8-16(14)10-22(18)28-24/h1-12H.
What are the key properties of 7-fluoro-2-(7-fluorobenzo[f][1]benzofuran-2-yl)benzo[f][1]benzofuran?
7-fluoro-2-(7-fluorobenzo[f][1]benzofuran-2-yl)benzo[f][1]benzofuran has a molecular weight of 370.35 g/mol, XLogP of 7.43, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-2-(7-fluorobenzo[f][1]benzofuran-2-yl)benzo[f][1]benzofuran is sourced from PubChem (CID 71108521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).