4-[2-(4-hydroxyphenyl)hex-5-enyl]phenol

C18H20O2 — CID 163921584

IUPAC4-[2-(4-hydroxyphenyl)hex-5-enyl]phenol
SMILESC=CCCC(Cc1ccc(O)cc1)c1ccc(O)cc1
InChIInChI=1S/C18H20O2/c1-2-3-4-16(15-7-11-18(20)12-8-15)13-14-5-9-17(19)10-6-14/h2,5-12,16,19-20H,1,3-4,13H2
InChIKeyRAVXSAFCEVWJGK-UHFFFAOYSA-N
MW268.36 g/mol
LogP4.39
Rot. Bonds6

About 4-[2-(4-hydroxyphenyl)hex-5-enyl]phenol

4-[2-(4-hydroxyphenyl)hex-5-enyl]phenol (PubChem CID 163921584) has the molecular formula C18H20O2 and a molecular weight of 268.36 g/mol. Its IUPAC name is 4-[2-(4-hydroxyphenyl)hex-5-enyl]phenol.

Molecular Properties

Compound Name4-[2-(4-hydroxyphenyl)hex-5-enyl]phenol
PubChem CID163921584
Molecular FormulaC18H20O2
Molecular Weight268.36 g/mol
Exact Mass268.15
IUPAC Name4-[2-(4-hydroxyphenyl)hex-5-enyl]phenol
SMILESC=CCCC(Cc1ccc(O)cc1)c1ccc(O)cc1
InChIInChI=1S/C18H20O2/c1-2-3-4-16(15-7-11-18(20)12-8-15)13-14-5-9-17(19)10-6-14/h2,5-12,16,19-20H,1,3-4,13H2
InChIKeyRAVXSAFCEVWJGK-UHFFFAOYSA-N
XLogP4.39
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 54.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(4-hydroxyphenyl)hex-5-enyl]phenol?
The IUPAC name of 4-[2-(4-hydroxyphenyl)hex-5-enyl]phenol (CID 163921584) is 4-[2-(4-hydroxyphenyl)hex-5-enyl]phenol.
What is the SMILES notation for 4-[2-(4-hydroxyphenyl)hex-5-enyl]phenol?
The canonical SMILES for 4-[2-(4-hydroxyphenyl)hex-5-enyl]phenol is C=CCCC(Cc1ccc(O)cc1)c1ccc(O)cc1.
What is the InChIKey of 4-[2-(4-hydroxyphenyl)hex-5-enyl]phenol?
The InChIKey is RAVXSAFCEVWJGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20O2/c1-2-3-4-16(15-7-11-18(20)12-8-15)13-14-5-9-17(19)10-6-14/h2,5-12,16,19-20H,1,3-4,13H2.
What are the key properties of 4-[2-(4-hydroxyphenyl)hex-5-enyl]phenol?
4-[2-(4-hydroxyphenyl)hex-5-enyl]phenol has a molecular weight of 268.36 g/mol, XLogP of 4.39, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-hydroxyphenyl)hex-5-enyl]phenol is sourced from PubChem (CID 163921584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).