[2-[2-(hydroxymethyl)phenyl]phenyl]-diphenylmethanol

C26H22O2 — CID 102081145

IUPAC[2-[2-(hydroxymethyl)phenyl]phenyl]-diphenylmethanol
SMILESOCc1ccccc1-c1ccccc1C(O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C26H22O2/c27-19-20-11-7-8-16-23(20)24-17-9-10-18-25(24)26(28,21-12-3-1-4-13-21)22-14-5-2-6-15-22/h1-18,27-28H,19H2
InChIKeyMOQVLRWADZSVFN-UHFFFAOYSA-N
MW366.46 g/mol
LogP5.13
Rot. Bonds5

About [2-[2-(hydroxymethyl)phenyl]phenyl]-diphenylmethanol

[2-[2-(hydroxymethyl)phenyl]phenyl]-diphenylmethanol (PubChem CID 102081145) has the molecular formula C26H22O2 and a molecular weight of 366.46 g/mol. Its IUPAC name is [2-[2-(hydroxymethyl)phenyl]phenyl]-diphenylmethanol.

Molecular Properties

Compound Name[2-[2-(hydroxymethyl)phenyl]phenyl]-diphenylmethanol
PubChem CID102081145
Molecular FormulaC26H22O2
Molecular Weight366.46 g/mol
Exact Mass366.16
IUPAC Name[2-[2-(hydroxymethyl)phenyl]phenyl]-diphenylmethanol
SMILESOCc1ccccc1-c1ccccc1C(O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C26H22O2/c27-19-20-11-7-8-16-23(20)24-17-9-10-18-25(24)26(28,21-12-3-1-4-13-21)22-14-5-2-6-15-22/h1-18,27-28H,19H2
InChIKeyMOQVLRWADZSVFN-UHFFFAOYSA-N
XLogP5.13
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms28
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.46
LogP ≤ 55.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [2-[2-(hydroxymethyl)phenyl]phenyl]-diphenylmethanol?
The IUPAC name of [2-[2-(hydroxymethyl)phenyl]phenyl]-diphenylmethanol (CID 102081145) is [2-[2-(hydroxymethyl)phenyl]phenyl]-diphenylmethanol.
What is the SMILES notation for [2-[2-(hydroxymethyl)phenyl]phenyl]-diphenylmethanol?
The canonical SMILES for [2-[2-(hydroxymethyl)phenyl]phenyl]-diphenylmethanol is OCc1ccccc1-c1ccccc1C(O)(c1ccccc1)c1ccccc1.
What is the InChIKey of [2-[2-(hydroxymethyl)phenyl]phenyl]-diphenylmethanol?
The InChIKey is MOQVLRWADZSVFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H22O2/c27-19-20-11-7-8-16-23(20)24-17-9-10-18-25(24)26(28,21-12-3-1-4-13-21)22-14-5-2-6-15-22/h1-18,27-28H,19H2.
What are the key properties of [2-[2-(hydroxymethyl)phenyl]phenyl]-diphenylmethanol?
[2-[2-(hydroxymethyl)phenyl]phenyl]-diphenylmethanol has a molecular weight of 366.46 g/mol, XLogP of 5.13, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[2-(hydroxymethyl)phenyl]phenyl]-diphenylmethanol is sourced from PubChem (CID 102081145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).