10-phenyl-12H-fluoreno[1,2-b][1]benzofuran

C25H16O — CID 164962558

IUPAC10-phenyl-12H-fluoreno[1,2-b][1]benzofuran
SMILESc1ccc(-c2cccc3c2oc2c4c(ccc23)-c2ccccc2C4)cc1
InChIInChI=1S/C25H16O/c1-2-7-16(8-3-1)19-11-6-12-21-22-14-13-20-18-10-5-4-9-17(18)15-23(20)25(22)26-24(19)21/h1-14H,15H2
InChIKeyVEGOKHMMGCYKEV-UHFFFAOYSA-N
MW332.40 g/mol
LogP6.82
Rot. Bonds1

About 10-phenyl-12H-fluoreno[1,2-b][1]benzofuran

10-phenyl-12H-fluoreno[1,2-b][1]benzofuran (PubChem CID 164962558) has the molecular formula C25H16O and a molecular weight of 332.40 g/mol. Its IUPAC name is 10-phenyl-12H-fluoreno[1,2-b][1]benzofuran.

Molecular Properties

Compound Name10-phenyl-12H-fluoreno[1,2-b][1]benzofuran
PubChem CID164962558
Molecular FormulaC25H16O
Molecular Weight332.40 g/mol
Exact Mass332.12
IUPAC Name10-phenyl-12H-fluoreno[1,2-b][1]benzofuran
SMILESc1ccc(-c2cccc3c2oc2c4c(ccc23)-c2ccccc2C4)cc1
InChIInChI=1S/C25H16O/c1-2-7-16(8-3-1)19-11-6-12-21-22-14-13-20-18-10-5-4-9-17(18)15-23(20)25(22)26-24(19)21/h1-14H,15H2
InChIKeyVEGOKHMMGCYKEV-UHFFFAOYSA-N
XLogP6.82
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500332.40
LogP ≤ 56.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 10-phenyl-12H-fluoreno[1,2-b][1]benzofuran?
The IUPAC name of 10-phenyl-12H-fluoreno[1,2-b][1]benzofuran (CID 164962558) is 10-phenyl-12H-fluoreno[1,2-b][1]benzofuran.
What is the SMILES notation for 10-phenyl-12H-fluoreno[1,2-b][1]benzofuran?
The canonical SMILES for 10-phenyl-12H-fluoreno[1,2-b][1]benzofuran is c1ccc(-c2cccc3c2oc2c4c(ccc23)-c2ccccc2C4)cc1.
What is the InChIKey of 10-phenyl-12H-fluoreno[1,2-b][1]benzofuran?
The InChIKey is VEGOKHMMGCYKEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H16O/c1-2-7-16(8-3-1)19-11-6-12-21-22-14-13-20-18-10-5-4-9-17(18)15-23(20)25(22)26-24(19)21/h1-14H,15H2.
What are the key properties of 10-phenyl-12H-fluoreno[1,2-b][1]benzofuran?
10-phenyl-12H-fluoreno[1,2-b][1]benzofuran has a molecular weight of 332.40 g/mol, XLogP of 6.82, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 10-phenyl-12H-fluoreno[1,2-b][1]benzofuran is sourced from PubChem (CID 164962558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).