2,4,6-triphenyl-4H-pyran

C23H18O — CID 555396

IUPAC2,4,6-triphenyl-4H-pyran
SMILESC1=C(c2ccccc2)OC(c2ccccc2)=CC1c1ccccc1
InChIInChI=1S/C23H18O/c1-4-10-18(11-5-1)21-16-22(19-12-6-2-7-13-19)24-23(17-21)20-14-8-3-9-15-20/h1-17,21H
InChIKeyGIPVJEYAHJLFPQ-UHFFFAOYSA-N
MW310.40 g/mol
LogP5.88
Rot. Bonds3

About 2,4,6-triphenyl-4H-pyran

2,4,6-triphenyl-4H-pyran (PubChem CID 555396) has the molecular formula C23H18O and a molecular weight of 310.40 g/mol. Its IUPAC name is 2,4,6-triphenyl-4H-pyran.

Molecular Properties

Compound Name2,4,6-triphenyl-4H-pyran
PubChem CID555396
Molecular FormulaC23H18O
Molecular Weight310.40 g/mol
Exact Mass310.14
IUPAC Name2,4,6-triphenyl-4H-pyran
SMILESC1=C(c2ccccc2)OC(c2ccccc2)=CC1c1ccccc1
InChIInChI=1S/C23H18O/c1-4-10-18(11-5-1)21-16-22(19-12-6-2-7-13-19)24-23(17-21)20-14-8-3-9-15-20/h1-17,21H
InChIKeyGIPVJEYAHJLFPQ-UHFFFAOYSA-N
XLogP5.88
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500310.40
LogP ≤ 55.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,4,6-triphenyl-4H-pyran?
The IUPAC name of 2,4,6-triphenyl-4H-pyran (CID 555396) is 2,4,6-triphenyl-4H-pyran.
What is the SMILES notation for 2,4,6-triphenyl-4H-pyran?
The canonical SMILES for 2,4,6-triphenyl-4H-pyran is C1=C(c2ccccc2)OC(c2ccccc2)=CC1c1ccccc1.
What is the InChIKey of 2,4,6-triphenyl-4H-pyran?
The InChIKey is GIPVJEYAHJLFPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18O/c1-4-10-18(11-5-1)21-16-22(19-12-6-2-7-13-19)24-23(17-21)20-14-8-3-9-15-20/h1-17,21H.
What are the key properties of 2,4,6-triphenyl-4H-pyran?
2,4,6-triphenyl-4H-pyran has a molecular weight of 310.40 g/mol, XLogP of 5.88, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,6-triphenyl-4H-pyran is sourced from PubChem (CID 555396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).