[2-[(2-diphenylphosphanylphenyl)-diphenylgermyl]phenyl]-diphenylphosphane

C48H38GeP2 — CID 177406869

IUPAC[2-[(2-diphenylphosphanylphenyl)-diphenylgermyl]phenyl]-diphenylphosphane
SMILESc1ccc(P(c2ccccc2)c2ccccc2[Ge](c2ccccc2)(c2ccccc2)c2ccccc2P(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C48H38GeP2/c1-7-23-39(24-8-1)49(40-25-9-2-10-26-40,45-35-19-21-37-47(45)50(41-27-11-3-12-28-41)42-29-13-4-14-30-42)46-36-20-22-38-48(46)51(43-31-15-5-16-32-43)44-33-17-6-18-34-44/h1-38H
InChIKeySMABLNMVZNREJH-UHFFFAOYSA-N
MW749.39 g/mol
LogP6.58
Rot. Bonds10

About [2-[(2-diphenylphosphanylphenyl)-diphenylgermyl]phenyl]-diphenylphosphane

[2-[(2-diphenylphosphanylphenyl)-diphenylgermyl]phenyl]-diphenylphosphane (PubChem CID 177406869) has the molecular formula C48H38GeP2 and a molecular weight of 749.39 g/mol. Its IUPAC name is [2-[(2-diphenylphosphanylphenyl)-diphenylgermyl]phenyl]-diphenylphosphane.

Molecular Properties

Compound Name[2-[(2-diphenylphosphanylphenyl)-diphenylgermyl]phenyl]-diphenylphosphane
PubChem CID177406869
Molecular FormulaC48H38GeP2
Molecular Weight749.39 g/mol
Exact Mass750.17
IUPAC Name[2-[(2-diphenylphosphanylphenyl)-diphenylgermyl]phenyl]-diphenylphosphane
SMILESc1ccc(P(c2ccccc2)c2ccccc2[Ge](c2ccccc2)(c2ccccc2)c2ccccc2P(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C48H38GeP2/c1-7-23-39(24-8-1)49(40-25-9-2-10-26-40,45-35-19-21-37-47(45)50(41-27-11-3-12-28-41)42-29-13-4-14-30-42)46-36-20-22-38-48(46)51(43-31-15-5-16-32-43)44-33-17-6-18-34-44/h1-38H
InChIKeySMABLNMVZNREJH-UHFFFAOYSA-N
XLogP6.58
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms51
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500749.39
LogP ≤ 56.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(2-diphenylphosphanylphenyl)-diphenylphosphane;titanium
CID 174974517
4-[(2-diphenylphosphanylphenyl)-dimethylgermyl]-N,N-dimethylaniline
CID 177499264
bis([2-(2-diphenylphosphanylphenyl)phenyl]-diphenylphosphane);hydrate
CID 87203660
triphenylphosphane
CID 139056248
dichloro-(2-diphenylphosphanylphenyl)phosphane
CID 5108470
iodocopper;triphenylphosphane
CID 12549340
silane;triphenylphosphane
CID 161037280
copper monohydride;hexakis(triphenylphosphane)
CID 134992255
tetrakis(triphenylphosphane);dihydrochloride
CID 172855409
triphenylphosphane;yttrium
CID 139917776
tris(triphenylphosphane);hydrobromide
CID 172722268
palladium;bis(triphenylphosphane)
CID 10122028

Frequently Asked Questions

What is the IUPAC name of [2-[(2-diphenylphosphanylphenyl)-diphenylgermyl]phenyl]-diphenylphosphane?
The IUPAC name of [2-[(2-diphenylphosphanylphenyl)-diphenylgermyl]phenyl]-diphenylphosphane (CID 177406869) is [2-[(2-diphenylphosphanylphenyl)-diphenylgermyl]phenyl]-diphenylphosphane.
What is the SMILES notation for [2-[(2-diphenylphosphanylphenyl)-diphenylgermyl]phenyl]-diphenylphosphane?
The canonical SMILES for [2-[(2-diphenylphosphanylphenyl)-diphenylgermyl]phenyl]-diphenylphosphane is c1ccc(P(c2ccccc2)c2ccccc2[Ge](c2ccccc2)(c2ccccc2)c2ccccc2P(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of [2-[(2-diphenylphosphanylphenyl)-diphenylgermyl]phenyl]-diphenylphosphane?
The InChIKey is SMABLNMVZNREJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H38GeP2/c1-7-23-39(24-8-1)49(40-25-9-2-10-26-40,45-35-19-21-37-47(45)50(41-27-11-3-12-28-41)42-29-13-4-14-30-42)46-36-20-22-38-48(46)51(43-31-15-5-16-32-43)44-33-17-6-18-34-44/h1-38H.
What are the key properties of [2-[(2-diphenylphosphanylphenyl)-diphenylgermyl]phenyl]-diphenylphosphane?
[2-[(2-diphenylphosphanylphenyl)-diphenylgermyl]phenyl]-diphenylphosphane has a molecular weight of 749.39 g/mol, XLogP of 6.58, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(2-diphenylphosphanylphenyl)-diphenylgermyl]phenyl]-diphenylphosphane is sourced from PubChem (CID 177406869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).