4-(4-hydroxyphenoxy)-2-[(4-hydroxyphenyl)methyl]phenol

C19H16O4 — CID 155547363

IUPAC4-(4-hydroxyphenoxy)-2-[(4-hydroxyphenyl)methyl]phenol
SMILESOc1ccc(Cc2cc(Oc3ccc(O)cc3)ccc2O)cc1
InChIInChI=1S/C19H16O4/c20-15-3-1-13(2-4-15)11-14-12-18(9-10-19(14)22)23-17-7-5-16(21)6-8-17/h1-10,12,20-22H,11H2
InChIKeyLMHJECDLPFXXEP-UHFFFAOYSA-N
MW308.33 g/mol
LogP4.19
Rot. Bonds4

About 4-(4-hydroxyphenoxy)-2-[(4-hydroxyphenyl)methyl]phenol

4-(4-hydroxyphenoxy)-2-[(4-hydroxyphenyl)methyl]phenol (PubChem CID 155547363) has the molecular formula C19H16O4 and a molecular weight of 308.33 g/mol. Its IUPAC name is 4-(4-hydroxyphenoxy)-2-[(4-hydroxyphenyl)methyl]phenol.

Molecular Properties

Compound Name4-(4-hydroxyphenoxy)-2-[(4-hydroxyphenyl)methyl]phenol
PubChem CID155547363
Molecular FormulaC19H16O4
Molecular Weight308.33 g/mol
Exact Mass308.10
IUPAC Name4-(4-hydroxyphenoxy)-2-[(4-hydroxyphenyl)methyl]phenol
SMILESOc1ccc(Cc2cc(Oc3ccc(O)cc3)ccc2O)cc1
InChIInChI=1S/C19H16O4/c20-15-3-1-13(2-4-15)11-14-12-18(9-10-19(14)22)23-17-7-5-16(21)6-8-17/h1-10,12,20-22H,11H2
InChIKeyLMHJECDLPFXXEP-UHFFFAOYSA-N
XLogP4.19
TPSA69.92 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.33
LogP ≤ 54.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

Delta-Tocopherol
CID 92094
Etofenprox
CID 71245
Delta-Tocotrienol
CID 5282350
Tocotrienol
CID 9929901
Erteberel
CID 10286159
Riccardin D
CID 11510446
4-(4'-Hydroxyphenyl)-2,2,4-trimethylchroman
CID 97788
5-Pentyl-2-phenoxyphenol
CID 5274976
4-Methoxyhonokiol
CID 155160
2H-1-Benzopyran-6-ol, 3,4-dihydro-2,8-dimethyl-2-(4,8,12-trimethyltridecyl)-, [2R-[2R*(4R*,8R*)]]-
CID 586537
eta-Tocopherol
CID 9887390
5-Hexyl-2-phenoxyphenol
CID 5274977

Frequently Asked Questions

What is the IUPAC name of 4-(4-hydroxyphenoxy)-2-[(4-hydroxyphenyl)methyl]phenol?
The IUPAC name of 4-(4-hydroxyphenoxy)-2-[(4-hydroxyphenyl)methyl]phenol (CID 155547363) is 4-(4-hydroxyphenoxy)-2-[(4-hydroxyphenyl)methyl]phenol.
What is the SMILES notation for 4-(4-hydroxyphenoxy)-2-[(4-hydroxyphenyl)methyl]phenol?
The canonical SMILES for 4-(4-hydroxyphenoxy)-2-[(4-hydroxyphenyl)methyl]phenol is Oc1ccc(Cc2cc(Oc3ccc(O)cc3)ccc2O)cc1.
What is the InChIKey of 4-(4-hydroxyphenoxy)-2-[(4-hydroxyphenyl)methyl]phenol?
The InChIKey is LMHJECDLPFXXEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16O4/c20-15-3-1-13(2-4-15)11-14-12-18(9-10-19(14)22)23-17-7-5-16(21)6-8-17/h1-10,12,20-22H,11H2.
What are the key properties of 4-(4-hydroxyphenoxy)-2-[(4-hydroxyphenyl)methyl]phenol?
4-(4-hydroxyphenoxy)-2-[(4-hydroxyphenyl)methyl]phenol has a molecular weight of 308.33 g/mol, XLogP of 4.19, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-hydroxyphenoxy)-2-[(4-hydroxyphenyl)methyl]phenol is sourced from PubChem (CID 155547363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).