2-(2-hydroxy-5-phenylmethoxyphenyl)-4-phenylmethoxyphenol

C26H22O4 — CID 71613877

IUPAC2-(2-hydroxy-5-phenylmethoxyphenyl)-4-phenylmethoxyphenol
SMILESOc1ccc(OCc2ccccc2)cc1-c1cc(OCc2ccccc2)ccc1O
InChIInChI=1S/C26H22O4/c27-25-13-11-21(29-17-19-7-3-1-4-8-19)15-23(25)24-16-22(12-14-26(24)28)30-18-20-9-5-2-6-10-20/h1-16,27-28H,17-18H2
InChIKeyPTFKDUVCXOSWCX-UHFFFAOYSA-N
MW398.46 g/mol
LogP5.92
Rot. Bonds7

About 2-(2-hydroxy-5-phenylmethoxyphenyl)-4-phenylmethoxyphenol

2-(2-hydroxy-5-phenylmethoxyphenyl)-4-phenylmethoxyphenol (PubChem CID 71613877) has the molecular formula C26H22O4 and a molecular weight of 398.46 g/mol. Its IUPAC name is 2-(2-hydroxy-5-phenylmethoxyphenyl)-4-phenylmethoxyphenol.

Molecular Properties

Compound Name2-(2-hydroxy-5-phenylmethoxyphenyl)-4-phenylmethoxyphenol
PubChem CID71613877
Molecular FormulaC26H22O4
Molecular Weight398.46 g/mol
Exact Mass398.15
IUPAC Name2-(2-hydroxy-5-phenylmethoxyphenyl)-4-phenylmethoxyphenol
SMILESOc1ccc(OCc2ccccc2)cc1-c1cc(OCc2ccccc2)ccc1O
InChIInChI=1S/C26H22O4/c27-25-13-11-21(29-17-19-7-3-1-4-8-19)15-23(25)24-16-22(12-14-26(24)28)30-18-20-9-5-2-6-10-20/h1-16,27-28H,17-18H2
InChIKeyPTFKDUVCXOSWCX-UHFFFAOYSA-N
XLogP5.92
TPSA58.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500398.46
LogP ≤ 55.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-phenyl-5-phenylmethoxyphenol
CID 123808909
4-phenylmethoxy-2-[2-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)phenyl]phenol
CID 139964893
phenoxymethylbenzene;2-phenylphenol
CID 159234068
2,6-bis(phenylmethoxy)anthracene-9,10-dione
CID 147621413
2-phenyl-4-(2-phenylethoxy)phenol
CID 57032824
2-[(tert-butylamino)methyl]-5-phenylmethoxyphenol
CID 59768381
2-[(E)-C-benzyl-N-hydroxycarbonimidoyl]-5-phenylmethoxyphenol
CID 135699535
1-(2-hydroxy-4-phenylmethoxyphenyl)propane-1,2,3-triol
CID 170819017
2-[(1R)-1-amino-2-hydroxyethyl]-5-phenylmethoxyphenol;hydrochloride
CID 171234127
1,3-diphenylbenzene;4-phenylmethoxyphenol
CID 70041760
8-methylidene-3-phenylmethoxybicyclo[4.2.0]octa-1(6),2,4-triene
CID 58380051
2-(4-hydroxyphenyl)-4-phenylmethoxybenzenesulfinate
CID 174520543

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxy-5-phenylmethoxyphenyl)-4-phenylmethoxyphenol?
The IUPAC name of 2-(2-hydroxy-5-phenylmethoxyphenyl)-4-phenylmethoxyphenol (CID 71613877) is 2-(2-hydroxy-5-phenylmethoxyphenyl)-4-phenylmethoxyphenol.
What is the SMILES notation for 2-(2-hydroxy-5-phenylmethoxyphenyl)-4-phenylmethoxyphenol?
The canonical SMILES for 2-(2-hydroxy-5-phenylmethoxyphenyl)-4-phenylmethoxyphenol is Oc1ccc(OCc2ccccc2)cc1-c1cc(OCc2ccccc2)ccc1O.
What is the InChIKey of 2-(2-hydroxy-5-phenylmethoxyphenyl)-4-phenylmethoxyphenol?
The InChIKey is PTFKDUVCXOSWCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H22O4/c27-25-13-11-21(29-17-19-7-3-1-4-8-19)15-23(25)24-16-22(12-14-26(24)28)30-18-20-9-5-2-6-10-20/h1-16,27-28H,17-18H2.
What are the key properties of 2-(2-hydroxy-5-phenylmethoxyphenyl)-4-phenylmethoxyphenol?
2-(2-hydroxy-5-phenylmethoxyphenyl)-4-phenylmethoxyphenol has a molecular weight of 398.46 g/mol, XLogP of 5.92, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxy-5-phenylmethoxyphenyl)-4-phenylmethoxyphenol is sourced from PubChem (CID 71613877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).