4-[phenoxy(phenyl)methyl]phenol

C19H16O2 — CID 174712499

IUPAC4-[phenoxy(phenyl)methyl]phenol
SMILESOc1ccc(C(Oc2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C19H16O2/c20-17-13-11-16(12-14-17)19(15-7-3-1-4-8-15)21-18-9-5-2-6-10-18/h1-14,19-20H
InChIKeyDLTIMIAZVYVUOI-UHFFFAOYSA-N
MW276.33 g/mol
LogP4.56
Rot. Bonds4

About 4-[phenoxy(phenyl)methyl]phenol

4-[phenoxy(phenyl)methyl]phenol (PubChem CID 174712499) has the molecular formula C19H16O2 and a molecular weight of 276.33 g/mol. Its IUPAC name is 4-[phenoxy(phenyl)methyl]phenol.

Molecular Properties

Compound Name4-[phenoxy(phenyl)methyl]phenol
PubChem CID174712499
Molecular FormulaC19H16O2
Molecular Weight276.33 g/mol
Exact Mass276.12
IUPAC Name4-[phenoxy(phenyl)methyl]phenol
SMILESOc1ccc(C(Oc2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C19H16O2/c20-17-13-11-16(12-14-17)19(15-7-3-1-4-8-15)21-18-9-5-2-6-10-18/h1-14,19-20H
InChIKeyDLTIMIAZVYVUOI-UHFFFAOYSA-N
XLogP4.56
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.33
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[phenoxy(phenyl)methyl]phenol?
The IUPAC name of 4-[phenoxy(phenyl)methyl]phenol (CID 174712499) is 4-[phenoxy(phenyl)methyl]phenol.
What is the SMILES notation for 4-[phenoxy(phenyl)methyl]phenol?
The canonical SMILES for 4-[phenoxy(phenyl)methyl]phenol is Oc1ccc(C(Oc2ccccc2)c2ccccc2)cc1.
What is the InChIKey of 4-[phenoxy(phenyl)methyl]phenol?
The InChIKey is DLTIMIAZVYVUOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16O2/c20-17-13-11-16(12-14-17)19(15-7-3-1-4-8-15)21-18-9-5-2-6-10-18/h1-14,19-20H.
What are the key properties of 4-[phenoxy(phenyl)methyl]phenol?
4-[phenoxy(phenyl)methyl]phenol has a molecular weight of 276.33 g/mol, XLogP of 4.56, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[phenoxy(phenyl)methyl]phenol is sourced from PubChem (CID 174712499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).