[1-[2-(diphenylphosphanylmethyl)-3-phenylnaphthalen-1-yl]-3-phenylnaphthalen-2-yl]methyl-diphenylphosphane;tetrakis(2-ethyl-1-(2-ethyl-3-phenylnaphthalen-1-yl)-3-phenylnaphthalene)

C202H164P2 — CID 162119112

IUPAC[1-[2-(diphenylphosphanylmethyl)-3-phenylnaphthalen-1-yl]-3-phenylnaphthalen-2-yl]methyl-diphenylphosphane;tetrakis(2-ethyl-1-(2-ethyl-3-phenylnaphthalen-1-yl)-3-phenylnaphthalene)
SMILESCCc1c(-c2ccccc2)cc2ccccc2c1-c1c(CC)c(-c2ccccc2)cc2ccccc12.CCc1c(-c2ccccc2)cc2ccccc2c1-c1c(CC)c(-c2ccccc2)cc2ccccc12.CCc1c(-c2ccccc2)cc2ccccc2c1-c1c(CC)c(-c2ccccc2)cc2ccccc12.CCc1c(-c2ccccc2)cc2ccccc2c1-c1c(CC)c(-c2ccccc2)cc2ccccc12.c1ccc(-c2cc3ccccc3c(-c3c(CP(c4ccccc4)c4ccccc4)c(-c4ccccc4)cc4ccccc34)c2CP(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C58H44P2.4C36H30/c1-7-23-43(24-8-1)53-39-45-27-19-21-37-51(45)57(55(53)41-59(47-29-11-3-12-30-47)48-31-13-4-14-32-48)58-52-38-22-20-28-46(52)40-54(44-25-9-2-10-26-44)56(58)42-60(49-33-15-5-16-34-49)50-35-17-6-18-36-50;4*1-3-29-33(25-15-7-5-8-16-25)23-27-19-11-13-21-31(27)35(29)36-30(4-2)34(26-17-9-6-10-18-26)24-28-20-12-14-22-32(28)36/h1-40H,41-42H2;4*5-24H,3-4H2,1-2H3
InChIKeyZHEBUFQZXTUSBG-UHFFFAOYSA-N
MW2653.48 g/mol
LogP54.74
Rot. Bonds31

About [1-[2-(diphenylphosphanylmethyl)-3-phenylnaphthalen-1-yl]-3-phenylnaphthalen-2-yl]methyl-diphenylphosphane;tetrakis(2-ethyl-1-(2-ethyl-3-phenylnaphthalen-1-yl)-3-phenylnaphthalene)

[1-[2-(diphenylphosphanylmethyl)-3-phenylnaphthalen-1-yl]-3-phenylnaphthalen-2-yl]methyl-diphenylphosphane;tetrakis(2-ethyl-1-(2-ethyl-3-phenylnaphthalen-1-yl)-3-phenylnaphthalene) (PubChem CID 162119112) has the molecular formula C202H164P2 and a molecular weight of 2653.48 g/mol. Its IUPAC name is [1-[2-(diphenylphosphanylmethyl)-3-phenylnaphthalen-1-yl]-3-phenylnaphthalen-2-yl]methyl-diphenylphosphane;tetrakis(2-ethyl-1-(2-ethyl-3-phenylnaphthalen-1-yl)-3-phenylnaphthalene).

Molecular Properties

Compound Name[1-[2-(diphenylphosphanylmethyl)-3-phenylnaphthalen-1-yl]-3-phenylnaphthalen-2-yl]methyl-diphenylphosphane;tetrakis(2-ethyl-1-(2-ethyl-3-phenylnaphthalen-1-yl)-3-phenylnaphthalene)
PubChem CID162119112
Molecular FormulaC202H164P2
Molecular Weight2653.48 g/mol
Exact Mass2651.23
IUPAC Name[1-[2-(diphenylphosphanylmethyl)-3-phenylnaphthalen-1-yl]-3-phenylnaphthalen-2-yl]methyl-diphenylphosphane;tetrakis(2-ethyl-1-(2-ethyl-3-phenylnaphthalen-1-yl)-3-phenylnaphthalene)
SMILESCCc1c(-c2ccccc2)cc2ccccc2c1-c1c(CC)c(-c2ccccc2)cc2ccccc12.CCc1c(-c2ccccc2)cc2ccccc2c1-c1c(CC)c(-c2ccccc2)cc2ccccc12.CCc1c(-c2ccccc2)cc2ccccc2c1-c1c(CC)c(-c2ccccc2)cc2ccccc12.CCc1c(-c2ccccc2)cc2ccccc2c1-c1c(CC)c(-c2ccccc2)cc2ccccc12.c1ccc(-c2cc3ccccc3c(-c3c(CP(c4ccccc4)c4ccccc4)c(-c4ccccc4)cc4ccccc34)c2CP(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C58H44P2.4C36H30/c1-7-23-43(24-8-1)53-39-45-27-19-21-37-51(45)57(55(53)41-59(47-29-11-3-12-30-47)48-31-13-4-14-32-48)58-52-38-22-20-28-46(52)40-54(44-25-9-2-10-26-44)56(58)42-60(49-33-15-5-16-34-49)50-35-17-6-18-36-50;4*1-3-29-33(25-15-7-5-8-16-25)23-27-19-11-13-21-31(27)35(29)36-30(4-2)34(26-17-9-6-10-18-26)24-28-20-12-14-22-32(28)36/h1-40H,41-42H2;4*5-24H,3-4H2,1-2H3
InChIKeyZHEBUFQZXTUSBG-UHFFFAOYSA-N
XLogP54.74
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds31
Heavy Atoms204
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002653.48
LogP ≤ 554.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze [1-[2-(diphenylphosphanylmethyl)-3-phenylnaphthalen-1-yl]-3-phenylnaphthalen-2-yl]methyl-diphenylphosphane;tetrakis(2-ethyl-1-(2-ethyl-3-phenylnaphthalen-1-yl)-3-phenylnaphthalene) 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-(diphenylphosphanylmethyl)-3-methylnaphthalen-1-yl]-3-methylnaphthalen-2-yl]methyl-diphenylphosphane
CID 10305313
[1-(2-diphenylphosphanyl-3-phenylnaphthalen-1-yl)-3-phenylnaphthalen-2-yl]-diphenylphosphane
CID 10284023
2-(bromomethyl)-1-[2-(bromomethyl)-3-(4-phenylphenyl)naphthalen-1-yl]-3-(4-phenylphenyl)naphthalene
CID 58898275
[1-(2-ethylnaphthalen-1-yl)naphthalen-2-yl]methyl-diphenylphosphane
CID 159069423
7-ethyl-4-[10-(2-phenylphenyl)anthracen-9-yl]benzo[a]anthracene
CID 168838173
3-(4-methylphenyl)-1,2-diphenylnaphthalene
CID 178068265
dilithium;1-(2-oxido-3-phenylnaphthalen-1-yl)-3-phenylnaphthalen-2-olate
CID 52936759
3,5-bis(diphenylphosphanylmethyl)-2,4,6-triethylphenol
CID 170562858
2-chloro-1,3-diphenylnaphthalene
CID 12697982
2,3-diethyl-1,4-diphenylbenzene
CID 59383229
[1-[2-[bis(3,5-dimethylphenyl)phosphanylmethyl]naphthalen-1-yl]naphthalen-2-yl]methyl-bis(3,5-dimethylphenyl)phosphane
CID 20820573
1-naphthalen-1-yl-3-phenylnaphthalen-2-ol
CID 11982733

Frequently Asked Questions

What is the IUPAC name of [1-[2-(diphenylphosphanylmethyl)-3-phenylnaphthalen-1-yl]-3-phenylnaphthalen-2-yl]methyl-diphenylphosphane;tetrakis(2-ethyl-1-(2-ethyl-3-phenylnaphthalen-1-yl)-3-phenylnaphthalene)?
The IUPAC name of [1-[2-(diphenylphosphanylmethyl)-3-phenylnaphthalen-1-yl]-3-phenylnaphthalen-2-yl]methyl-diphenylphosphane;tetrakis(2-ethyl-1-(2-ethyl-3-phenylnaphthalen-1-yl)-3-phenylnaphthalene) (CID 162119112) is [1-[2-(diphenylphosphanylmethyl)-3-phenylnaphthalen-1-yl]-3-phenylnaphthalen-2-yl]methyl-diphenylphosphane;tetrakis(2-ethyl-1-(2-ethyl-3-phenylnaphthalen-1-yl)-3-phenylnaphthalene).
What is the SMILES notation for [1-[2-(diphenylphosphanylmethyl)-3-phenylnaphthalen-1-yl]-3-phenylnaphthalen-2-yl]methyl-diphenylphosphane;tetrakis(2-ethyl-1-(2-ethyl-3-phenylnaphthalen-1-yl)-3-phenylnaphthalene)?
The canonical SMILES for [1-[2-(diphenylphosphanylmethyl)-3-phenylnaphthalen-1-yl]-3-phenylnaphthalen-2-yl]methyl-diphenylphosphane;tetrakis(2-ethyl-1-(2-ethyl-3-phenylnaphthalen-1-yl)-3-phenylnaphthalene) is CCc1c(-c2ccccc2)cc2ccccc2c1-c1c(CC)c(-c2ccccc2)cc2ccccc12.CCc1c(-c2ccccc2)cc2ccccc2c1-c1c(CC)c(-c2ccccc2)cc2ccccc12.CCc1c(-c2ccccc2)cc2ccccc2c1-c1c(CC)c(-c2ccccc2)cc2ccccc12.CCc1c(-c2ccccc2)cc2ccccc2c1-c1c(CC)c(-c2ccccc2)cc2ccccc12.c1ccc(-c2cc3ccccc3c(-c3c(CP(c4ccccc4)c4ccccc4)c(-c4ccccc4)cc4ccccc34)c2CP(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of [1-[2-(diphenylphosphanylmethyl)-3-phenylnaphthalen-1-yl]-3-phenylnaphthalen-2-yl]methyl-diphenylphosphane;tetrakis(2-ethyl-1-(2-ethyl-3-phenylnaphthalen-1-yl)-3-phenylnaphthalene)?
The InChIKey is ZHEBUFQZXTUSBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H44P2.4C36H30/c1-7-23-43(24-8-1)53-39-45-27-19-21-37-51(45)57(55(53)41-59(47-29-11-3-12-30-47)48-31-13-4-14-32-48)58-52-38-22-20-28-46(52)40-54(44-25-9-2-10-26-44)56(58)42-60(49-33-15-5-16-34-49)50-35-17-6-18-36-50;4*1-3-29-33(25-15-7-5-8-16-25)23-27-19-11-13-21-31(27)35(29)36-30(4-2)34(26-17-9-6-10-18-26)24-28-20-12-14-22-32(28)36/h1-40H,41-42H2;4*5-24H,3-4H2,1-2H3.
What are the key properties of [1-[2-(diphenylphosphanylmethyl)-3-phenylnaphthalen-1-yl]-3-phenylnaphthalen-2-yl]methyl-diphenylphosphane;tetrakis(2-ethyl-1-(2-ethyl-3-phenylnaphthalen-1-yl)-3-phenylnaphthalene)?
[1-[2-(diphenylphosphanylmethyl)-3-phenylnaphthalen-1-yl]-3-phenylnaphthalen-2-yl]methyl-diphenylphosphane;tetrakis(2-ethyl-1-(2-ethyl-3-phenylnaphthalen-1-yl)-3-phenylnaphthalene) has a molecular weight of 2653.48 g/mol, XLogP of 54.74, 31 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[2-(diphenylphosphanylmethyl)-3-phenylnaphthalen-1-yl]-3-phenylnaphthalen-2-yl]methyl-diphenylphosphane;tetrakis(2-ethyl-1-(2-ethyl-3-phenylnaphthalen-1-yl)-3-phenylnaphthalene) is sourced from PubChem (CID 162119112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).