4-[1-(4-hydroxyphenyl)-2-phenylhex-1-enyl]phenol

C24H24O2 — CID 10871661

IUPAC4-[1-(4-hydroxyphenyl)-2-phenylhex-1-enyl]phenol
SMILESCCCCC(=C(c1ccc(O)cc1)c1ccc(O)cc1)c1ccccc1
InChIInChI=1S/C24H24O2/c1-2-3-9-23(18-7-5-4-6-8-18)24(19-10-14-21(25)15-11-19)20-12-16-22(26)17-13-20/h4-8,10-17,25-26H,2-3,9H2,1H3
InChIKeyLOSAKSLRALRQMY-UHFFFAOYSA-N
MW344.45 g/mol
LogP6.25
Rot. Bonds6

About 4-[1-(4-hydroxyphenyl)-2-phenylhex-1-enyl]phenol

4-[1-(4-hydroxyphenyl)-2-phenylhex-1-enyl]phenol (PubChem CID 10871661) has the molecular formula C24H24O2 and a molecular weight of 344.45 g/mol. Its IUPAC name is 4-[1-(4-hydroxyphenyl)-2-phenylhex-1-enyl]phenol.

Molecular Properties

Compound Name4-[1-(4-hydroxyphenyl)-2-phenylhex-1-enyl]phenol
PubChem CID10871661
Molecular FormulaC24H24O2
Molecular Weight344.45 g/mol
Exact Mass344.18
IUPAC Name4-[1-(4-hydroxyphenyl)-2-phenylhex-1-enyl]phenol
SMILESCCCCC(=C(c1ccc(O)cc1)c1ccc(O)cc1)c1ccccc1
InChIInChI=1S/C24H24O2/c1-2-3-9-23(18-7-5-4-6-8-18)24(19-10-14-21(25)15-11-19)20-12-16-22(26)17-13-20/h4-8,10-17,25-26H,2-3,9H2,1H3
InChIKeyLOSAKSLRALRQMY-UHFFFAOYSA-N
XLogP6.25
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500344.45
LogP ≤ 56.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-tert-Pentylphenol
CID 6643
P-Cresol
CID 2879
Diethylstilbestrol
CID 448537
Bisphenol A
CID 6623
2,4-Dimethylphenol
CID 7771
Dienestrol
CID 667476
(1,1'-Biphenyl)-2-ol
CID 7017
4-tert-Butylphenol
CID 7393
Tyrosol
CID 10393
Magnolol
CID 72300
Hexestrol
CID 192197
4-Nonylphenol
CID 1752

Frequently Asked Questions

What is the IUPAC name of 4-[1-(4-hydroxyphenyl)-2-phenylhex-1-enyl]phenol?
The IUPAC name of 4-[1-(4-hydroxyphenyl)-2-phenylhex-1-enyl]phenol (CID 10871661) is 4-[1-(4-hydroxyphenyl)-2-phenylhex-1-enyl]phenol.
What is the SMILES notation for 4-[1-(4-hydroxyphenyl)-2-phenylhex-1-enyl]phenol?
The canonical SMILES for 4-[1-(4-hydroxyphenyl)-2-phenylhex-1-enyl]phenol is CCCCC(=C(c1ccc(O)cc1)c1ccc(O)cc1)c1ccccc1.
What is the InChIKey of 4-[1-(4-hydroxyphenyl)-2-phenylhex-1-enyl]phenol?
The InChIKey is LOSAKSLRALRQMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24O2/c1-2-3-9-23(18-7-5-4-6-8-18)24(19-10-14-21(25)15-11-19)20-12-16-22(26)17-13-20/h4-8,10-17,25-26H,2-3,9H2,1H3.
What are the key properties of 4-[1-(4-hydroxyphenyl)-2-phenylhex-1-enyl]phenol?
4-[1-(4-hydroxyphenyl)-2-phenylhex-1-enyl]phenol has a molecular weight of 344.45 g/mol, XLogP of 6.25, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(4-hydroxyphenyl)-2-phenylhex-1-enyl]phenol is sourced from PubChem (CID 10871661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).