4-[4-(1-propoxyethyl)phenyl]phenol

C17H20O2 — CID 14533191

IUPAC4-[4-(1-propoxyethyl)phenyl]phenol
SMILESCCCOC(C)c1ccc(-c2ccc(O)cc2)cc1
InChIInChI=1S/C17H20O2/c1-3-12-19-13(2)14-4-6-15(7-5-14)16-8-10-17(18)11-9-16/h4-11,13,18H,3,12H2,1-2H3
InChIKeyMUIWFICCCCHINR-UHFFFAOYSA-N
MW256.35 g/mol
LogP4.55
Rot. Bonds5

About 4-[4-(1-propoxyethyl)phenyl]phenol

4-[4-(1-propoxyethyl)phenyl]phenol (PubChem CID 14533191) has the molecular formula C17H20O2 and a molecular weight of 256.35 g/mol. Its IUPAC name is 4-[4-(1-propoxyethyl)phenyl]phenol.

Molecular Properties

Compound Name4-[4-(1-propoxyethyl)phenyl]phenol
PubChem CID14533191
Molecular FormulaC17H20O2
Molecular Weight256.35 g/mol
Exact Mass256.15
IUPAC Name4-[4-(1-propoxyethyl)phenyl]phenol
SMILESCCCOC(C)c1ccc(-c2ccc(O)cc2)cc1
InChIInChI=1S/C17H20O2/c1-3-12-19-13(2)14-4-6-15(7-5-14)16-8-10-17(18)11-9-16/h4-11,13,18H,3,12H2,1-2H3
InChIKeyMUIWFICCCCHINR-UHFFFAOYSA-N
XLogP4.55
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[4-(1-propoxyethyl)phenyl]phenol?
The IUPAC name of 4-[4-(1-propoxyethyl)phenyl]phenol (CID 14533191) is 4-[4-(1-propoxyethyl)phenyl]phenol.
What is the SMILES notation for 4-[4-(1-propoxyethyl)phenyl]phenol?
The canonical SMILES for 4-[4-(1-propoxyethyl)phenyl]phenol is CCCOC(C)c1ccc(-c2ccc(O)cc2)cc1.
What is the InChIKey of 4-[4-(1-propoxyethyl)phenyl]phenol?
The InChIKey is MUIWFICCCCHINR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20O2/c1-3-12-19-13(2)14-4-6-15(7-5-14)16-8-10-17(18)11-9-16/h4-11,13,18H,3,12H2,1-2H3.
What are the key properties of 4-[4-(1-propoxyethyl)phenyl]phenol?
4-[4-(1-propoxyethyl)phenyl]phenol has a molecular weight of 256.35 g/mol, XLogP of 4.55, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(1-propoxyethyl)phenyl]phenol is sourced from PubChem (CID 14533191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).