[diphenyl(2-phenylethenoxy)methyl]benzene

C27H22O — CID 54172131

IUPAC[diphenyl(2-phenylethenoxy)methyl]benzene
SMILESC(=Cc1ccccc1)OC(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C27H22O/c1-5-13-23(14-6-1)21-22-28-27(24-15-7-2-8-16-24,25-17-9-3-10-18-25)26-19-11-4-12-20-26/h1-22H
InChIKeyOVTKEMABWDYEQV-UHFFFAOYSA-N
MW362.47 g/mol
LogP6.67
Rot. Bonds6

About [diphenyl(2-phenylethenoxy)methyl]benzene

[diphenyl(2-phenylethenoxy)methyl]benzene (PubChem CID 54172131) has the molecular formula C27H22O and a molecular weight of 362.47 g/mol. Its IUPAC name is [diphenyl(2-phenylethenoxy)methyl]benzene.

Molecular Properties

Compound Name[diphenyl(2-phenylethenoxy)methyl]benzene
PubChem CID54172131
Molecular FormulaC27H22O
Molecular Weight362.47 g/mol
Exact Mass362.17
IUPAC Name[diphenyl(2-phenylethenoxy)methyl]benzene
SMILESC(=Cc1ccccc1)OC(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C27H22O/c1-5-13-23(14-6-1)21-22-28-27(24-15-7-2-8-16-24,25-17-9-3-10-18-25)26-19-11-4-12-20-26/h1-22H
InChIKeyOVTKEMABWDYEQV-UHFFFAOYSA-N
XLogP6.67
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.47
LogP ≤ 56.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Analyze [diphenyl(2-phenylethenoxy)methyl]benzene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-phenylethenyl hypochlorite
CID 174846966
CID 67364349
CID 67364349
(E)-1-phenyl-N-trityloxymethanimine
CID 5382595
oxo-bis(2-phenylethenoxy)phosphanium
CID 57163740
oxo-bis[(E)-2-phenylethenoxy]phosphanium
CID 18676604
CID 70567885
CID 70567885
CID 70569152
CID 70569152
CID 154707954
CID 154707954
2-(chloromethoxy)ethenylbenzene
CID 54484183
(Z)-1,1,3-triphenylprop-2-en-1-ol
CID 92856099
tert-butyl-dimethyl-(2-phenylethenoxy)silane
CID 10466833
[(1Z,3Z)-4-phenylbuta-1,3-dienyl]benzene
CID 139179602

Frequently Asked Questions

What is the IUPAC name of [diphenyl(2-phenylethenoxy)methyl]benzene?
The IUPAC name of [diphenyl(2-phenylethenoxy)methyl]benzene (CID 54172131) is [diphenyl(2-phenylethenoxy)methyl]benzene.
What is the SMILES notation for [diphenyl(2-phenylethenoxy)methyl]benzene?
The canonical SMILES for [diphenyl(2-phenylethenoxy)methyl]benzene is C(=Cc1ccccc1)OC(c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of [diphenyl(2-phenylethenoxy)methyl]benzene?
The InChIKey is OVTKEMABWDYEQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H22O/c1-5-13-23(14-6-1)21-22-28-27(24-15-7-2-8-16-24,25-17-9-3-10-18-25)26-19-11-4-12-20-26/h1-22H.
What are the key properties of [diphenyl(2-phenylethenoxy)methyl]benzene?
[diphenyl(2-phenylethenoxy)methyl]benzene has a molecular weight of 362.47 g/mol, XLogP of 6.67, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [diphenyl(2-phenylethenoxy)methyl]benzene is sourced from PubChem (CID 54172131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).