[methylimino(diphenoxy)-λ5-phosphanyl]imino-diphenoxyphosphanium

C25H23N2O4P2+ — CID 134219885

IUPAC[methylimino(diphenoxy)-λ5-phosphanyl]imino-diphenoxyphosphanium
SMILESCN=P(N=[P+](Oc1ccccc1)Oc1ccccc1)(Oc1ccccc1)Oc1ccccc1
InChIInChI=1S/C25H23N2O4P2/c1-26-33(30-24-18-10-4-11-19-24,31-25-20-12-5-13-21-25)27-32(28-22-14-6-2-7-15-22)29-23-16-8-3-9-17-23/h2-21H,1H3/q+1
InChIKeyUWUAKWCGPIGUMZ-UHFFFAOYSA-N
MW477.42 g/mol
LogP8.37
Rot. Bonds9

About [methylimino(diphenoxy)-λ5-phosphanyl]imino-diphenoxyphosphanium

[methylimino(diphenoxy)-λ5-phosphanyl]imino-diphenoxyphosphanium (PubChem CID 134219885) has the molecular formula C25H23N2O4P2+ and a molecular weight of 477.42 g/mol. Its IUPAC name is [methylimino(diphenoxy)-λ5-phosphanyl]imino-diphenoxyphosphanium.

Molecular Properties

Compound Name[methylimino(diphenoxy)-λ5-phosphanyl]imino-diphenoxyphosphanium
PubChem CID134219885
Molecular FormulaC25H23N2O4P2+
Molecular Weight477.42 g/mol
Exact Mass477.11
IUPAC Name[methylimino(diphenoxy)-λ5-phosphanyl]imino-diphenoxyphosphanium
SMILESCN=P(N=[P+](Oc1ccccc1)Oc1ccccc1)(Oc1ccccc1)Oc1ccccc1
InChIInChI=1S/C25H23N2O4P2/c1-26-33(30-24-18-10-4-11-19-24,31-25-20-12-5-13-21-25)27-32(28-22-14-6-2-7-15-22)29-23-16-8-3-9-17-23/h2-21H,1H3/q+1
InChIKeyUWUAKWCGPIGUMZ-UHFFFAOYSA-N
XLogP8.37
TPSA61.64 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500477.42
LogP ≤ 58.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

ethane;methane;methyl-methylimino-diphenoxy-λ5-phosphane
CID 162217804
copper;oxo(diphenoxy)phosphanium
CID 158842365
bis(4-hydroxyphenoxy)phosphinimylimino-bis(4-hydroxyphenoxy)phosphanium
CID 147294333
[methyl(diphenoxy)-λ5-phosphanylidene]azanide;yttrium
CID 58152781
potassium diphenyl phosphate
CID 23671717
cesium diphenyl phosphate
CID 23664598
[amino(methyl)phosphoryl]oxybenzene
CID 11864135
2-methylpropane;triphenyl phosphate
CID 91193965
[4-(4-diphenoxyphosphoryloxyphenyl)phenoxy]-oxo-phenoxyphosphanium
CID 59104469
bis(4-diphenoxyphosphoryloxyphenyl) phenyl phosphate
CID 58066863
[4-(4-methylphenyl)phenyl] diphenyl phosphate;oxo(diphenoxy)phosphanium
CID 91420416
triphenyl phosphate;hydrate
CID 66881958

Frequently Asked Questions

What is the IUPAC name of [methylimino(diphenoxy)-λ5-phosphanyl]imino-diphenoxyphosphanium?
The IUPAC name of [methylimino(diphenoxy)-λ5-phosphanyl]imino-diphenoxyphosphanium (CID 134219885) is [methylimino(diphenoxy)-λ5-phosphanyl]imino-diphenoxyphosphanium.
What is the SMILES notation for [methylimino(diphenoxy)-λ5-phosphanyl]imino-diphenoxyphosphanium?
The canonical SMILES for [methylimino(diphenoxy)-λ5-phosphanyl]imino-diphenoxyphosphanium is CN=P(N=[P+](Oc1ccccc1)Oc1ccccc1)(Oc1ccccc1)Oc1ccccc1.
What is the InChIKey of [methylimino(diphenoxy)-λ5-phosphanyl]imino-diphenoxyphosphanium?
The InChIKey is UWUAKWCGPIGUMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23N2O4P2/c1-26-33(30-24-18-10-4-11-19-24,31-25-20-12-5-13-21-25)27-32(28-22-14-6-2-7-15-22)29-23-16-8-3-9-17-23/h2-21H,1H3/q+1.
What are the key properties of [methylimino(diphenoxy)-λ5-phosphanyl]imino-diphenoxyphosphanium?
[methylimino(diphenoxy)-λ5-phosphanyl]imino-diphenoxyphosphanium has a molecular weight of 477.42 g/mol, XLogP of 8.37, 9 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [methylimino(diphenoxy)-λ5-phosphanyl]imino-diphenoxyphosphanium is sourced from PubChem (CID 134219885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).