[4-[1-(4-hydroxyphenyl)-1-phenylethyl]phenyl]oxidanium

C20H19O2+ — CID 144946665

IUPAC[4-[1-(4-hydroxyphenyl)-1-phenylethyl]phenyl]oxidanium
SMILESCC(c1ccccc1)(c1ccc(O)cc1)c1ccc([OH2+])cc1
InChIInChI=1S/C20H18O2/c1-20(15-5-3-2-4-6-15,16-7-11-18(21)12-8-16)17-9-13-19(22)14-10-17/h2-14,21-22H,1H3/p+1
InChIKeyVOWWYDCFAISREI-UHFFFAOYSA-O
MW291.37 g/mol
LogP4.18
Rot. Bonds3

About [4-[1-(4-hydroxyphenyl)-1-phenylethyl]phenyl]oxidanium

[4-[1-(4-hydroxyphenyl)-1-phenylethyl]phenyl]oxidanium (PubChem CID 144946665) has the molecular formula C20H19O2+ and a molecular weight of 291.37 g/mol. Its IUPAC name is [4-[1-(4-hydroxyphenyl)-1-phenylethyl]phenyl]oxidanium.

Molecular Properties

Compound Name[4-[1-(4-hydroxyphenyl)-1-phenylethyl]phenyl]oxidanium
PubChem CID144946665
Molecular FormulaC20H19O2+
Molecular Weight291.37 g/mol
Exact Mass291.14
IUPAC Name[4-[1-(4-hydroxyphenyl)-1-phenylethyl]phenyl]oxidanium
SMILESCC(c1ccccc1)(c1ccc(O)cc1)c1ccc([OH2+])cc1
InChIInChI=1S/C20H18O2/c1-20(15-5-3-2-4-6-15,16-7-11-18(21)12-8-16)17-9-13-19(22)14-10-17/h2-14,21-22H,1H3/p+1
InChIKeyVOWWYDCFAISREI-UHFFFAOYSA-O
XLogP4.18
TPSA43.13 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.37
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'charged_oxygen_or_sulfur_atoms', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Related Compounds

copper;tetrakis(4-(2-phenylpropan-2-yl)phenol)
CID 87921790
4-[2-[4-[1,1-bis(4-hydroxyphenyl)ethyl]phenyl]propan-2-yl]phenol
CID 634278
[4-[1,1-bis[4-[hydroxy(diphenyl)methyl]phenyl]ethyl]phenyl]-diphenylmethanol
CID 153299511
4-[2-[4-[1,1-bis(4-hydroxyphenyl)ethyl]phenyl]propan-2-yl]phenol;ethane
CID 91392325
4-[1-(4-hydroxyphenyl)-1-phenylethyl]-2-(1,1,1-trifluoro-2-hydroxypropan-2-yl)phenol
CID 126486197
4-[(1,2,3,4,5,6-13C6)cyclohexatrienyl-(4-hydroxyphenyl)-phenylmethyl]phenol
CID 171380903
1-(1,1-diphenylethyl)-4-phenylbenzene
CID 143113230
[4-[1-(4-hydroxyphenyl)-1-phenylethyl]phenyl] 2-methylpropanoate
CID 89217434
4-[2-[4-[1,1-bis(4-hydroxyphenyl)ethyl]phenyl]propan-2-yl]phenol;4-(4-hydroxyphenyl)phenol;4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
CID 160883594
(3R)-3-(4-hydroxyphenyl)-3-phenylbutan-2-one
CID 86338935
1-(4-hydroxyphenyl)ethane-1,1-diol
CID 137436479
4-[1-[3-[1,1-bis(4-hydroxyphenyl)ethyl]-5-[1,1-bis(4-hydroxyphenyl)-2,2,2-triphenylethyl]-2,4,6-triphenylphenyl]-1-(4-hydroxyphenyl)ethyl]phenol
CID 88714547

Frequently Asked Questions

What is the IUPAC name of [4-[1-(4-hydroxyphenyl)-1-phenylethyl]phenyl]oxidanium?
The IUPAC name of [4-[1-(4-hydroxyphenyl)-1-phenylethyl]phenyl]oxidanium (CID 144946665) is [4-[1-(4-hydroxyphenyl)-1-phenylethyl]phenyl]oxidanium.
What is the SMILES notation for [4-[1-(4-hydroxyphenyl)-1-phenylethyl]phenyl]oxidanium?
The canonical SMILES for [4-[1-(4-hydroxyphenyl)-1-phenylethyl]phenyl]oxidanium is CC(c1ccccc1)(c1ccc(O)cc1)c1ccc([OH2+])cc1.
What is the InChIKey of [4-[1-(4-hydroxyphenyl)-1-phenylethyl]phenyl]oxidanium?
The InChIKey is VOWWYDCFAISREI-UHFFFAOYSA-O. The full InChI is InChI=1S/C20H18O2/c1-20(15-5-3-2-4-6-15,16-7-11-18(21)12-8-16)17-9-13-19(22)14-10-17/h2-14,21-22H,1H3/p+1.
What are the key properties of [4-[1-(4-hydroxyphenyl)-1-phenylethyl]phenyl]oxidanium?
[4-[1-(4-hydroxyphenyl)-1-phenylethyl]phenyl]oxidanium has a molecular weight of 291.37 g/mol, XLogP of 4.18, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[1-(4-hydroxyphenyl)-1-phenylethyl]phenyl]oxidanium is sourced from PubChem (CID 144946665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).