diphenyl-[1-(2-phenyl-1H-inden-1-yl)naphthalen-2-yl]phosphane

C37H27P — CID 139996216

IUPACdiphenyl-[1-(2-phenyl-1H-inden-1-yl)naphthalen-2-yl]phosphane
SMILESC1=C(c2ccccc2)C(c2c(P(c3ccccc3)c3ccccc3)ccc3ccccc23)c2ccccc21
InChIInChI=1S/C37H27P/c1-4-14-27(15-5-1)34-26-29-17-11-13-23-33(29)36(34)37-32-22-12-10-16-28(32)24-25-35(37)38(30-18-6-2-7-19-30)31-20-8-3-9-21-31/h1-26,36H
InChIKeyOFEIBFMRTZLRQM-UHFFFAOYSA-N
MW502.60 g/mol
LogP8.28
Rot. Bonds5

About diphenyl-[1-(2-phenyl-1H-inden-1-yl)naphthalen-2-yl]phosphane

diphenyl-[1-(2-phenyl-1H-inden-1-yl)naphthalen-2-yl]phosphane (PubChem CID 139996216) has the molecular formula C37H27P and a molecular weight of 502.60 g/mol. Its IUPAC name is diphenyl-[1-(2-phenyl-1H-inden-1-yl)naphthalen-2-yl]phosphane.

Molecular Properties

Compound Namediphenyl-[1-(2-phenyl-1H-inden-1-yl)naphthalen-2-yl]phosphane
PubChem CID139996216
Molecular FormulaC37H27P
Molecular Weight502.60 g/mol
Exact Mass502.19
IUPAC Namediphenyl-[1-(2-phenyl-1H-inden-1-yl)naphthalen-2-yl]phosphane
SMILESC1=C(c2ccccc2)C(c2c(P(c3ccccc3)c3ccccc3)ccc3ccccc23)c2ccccc21
InChIInChI=1S/C37H27P/c1-4-14-27(15-5-1)34-26-29-17-11-13-23-33(29)36(34)37-32-22-12-10-16-28(32)24-25-35(37)38(30-18-6-2-7-19-30)31-20-8-3-9-21-31/h1-26,36H
InChIKeyOFEIBFMRTZLRQM-UHFFFAOYSA-N
XLogP8.28
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500502.60
LogP ≤ 58.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze diphenyl-[1-(2-phenyl-1H-inden-1-yl)naphthalen-2-yl]phosphane 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

1-[2-(2-phenyl-1H-inden-1-yl)naphthalen-1-yl]ethanone
CID 139946466
[2-(2-phenyl-1H-inden-1-yl)naphthalen-1-yl]methanol
CID 23016258
acetic acid;[1-(2-diphenylphosphanyl-1,2-dihydronaphthalen-1-yl)naphthalen-2-yl]-diphenylphosphane;ruthenium
CID 163198946
9-naphthalen-2-yl-10-[4-(2-phenyl-1H-inden-1-yl)phenyl]anthracene
CID 123993670
2-[3,5-bis(2-phenyl-1H-inden-1-yl)phenyl]-4-naphthalen-1-ylquinoline
CID 144815588
bis([2-(2-phenyl-1H-inden-1-yl)phenyl]methanol);titanium;dichloride
CID 23015547
[1-(2-diphenylphosphanyl-1H-naphthalen-2-id-1-yl)naphthalen-2-yl]-diphenylphosphane;ruthenium(3+);diacetate
CID 18695341
bis([1-(2-diphenylphosphanylnaphthalen-1-yl)naphthalen-2-yl]-diphenylphosphane);bis(rhodium);dihydrate
CID 73162021
[1-(2-methylnaphthalen-1-yl)naphthalen-2-yl]-diphenylphosphane
CID 21335175
carbon monoxide;[1-(2-diphenylphosphanylnaphthalen-1-yl)naphthalen-2-yl]-diphenylphosphane;rhodium
CID 139254479
[1-(2-diphenylphosphanylnaphthalen-1-yl)naphthalen-2-yl]-diphenylphosphane;ruthenium(1+);acetate
CID 21202945
trinaphthalen-1-ylphosphane;triphenylphosphane
CID 158068976

Frequently Asked Questions

What is the IUPAC name of diphenyl-[1-(2-phenyl-1H-inden-1-yl)naphthalen-2-yl]phosphane?
The IUPAC name of diphenyl-[1-(2-phenyl-1H-inden-1-yl)naphthalen-2-yl]phosphane (CID 139996216) is diphenyl-[1-(2-phenyl-1H-inden-1-yl)naphthalen-2-yl]phosphane.
What is the SMILES notation for diphenyl-[1-(2-phenyl-1H-inden-1-yl)naphthalen-2-yl]phosphane?
The canonical SMILES for diphenyl-[1-(2-phenyl-1H-inden-1-yl)naphthalen-2-yl]phosphane is C1=C(c2ccccc2)C(c2c(P(c3ccccc3)c3ccccc3)ccc3ccccc23)c2ccccc21.
What is the InChIKey of diphenyl-[1-(2-phenyl-1H-inden-1-yl)naphthalen-2-yl]phosphane?
The InChIKey is OFEIBFMRTZLRQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H27P/c1-4-14-27(15-5-1)34-26-29-17-11-13-23-33(29)36(34)37-32-22-12-10-16-28(32)24-25-35(37)38(30-18-6-2-7-19-30)31-20-8-3-9-21-31/h1-26,36H.
What are the key properties of diphenyl-[1-(2-phenyl-1H-inden-1-yl)naphthalen-2-yl]phosphane?
diphenyl-[1-(2-phenyl-1H-inden-1-yl)naphthalen-2-yl]phosphane has a molecular weight of 502.60 g/mol, XLogP of 8.28, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for diphenyl-[1-(2-phenyl-1H-inden-1-yl)naphthalen-2-yl]phosphane is sourced from PubChem (CID 139996216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).