[[bis(trimethylsilyloxy)phosphoryl-bis(trimethylsilyl)methyl]-fluorooxyphosphoryl] hypofluorite

C13H36F2O6P2Si4 — CID 54308904

IUPAC[[bis(trimethylsilyloxy)phosphoryl-bis(trimethylsilyl)methyl]-fluorooxyphosphoryl] hypofluorite
SMILESC[Si](C)(C)OP(=O)(O[Si](C)(C)C)C([Si](C)(C)C)([Si](C)(C)C)P(=O)(OF)OF
InChIInChI=1S/C13H36F2O6P2Si4/c1-24(2,3)13(25(4,5)6,22(16,18-14)19-15)23(17,20-26(7,8)9)21-27(10,11)12/h1-12H3
InChIKeySJMPHDDTZWXWKR-UHFFFAOYSA-N
MW500.71 g/mol
LogP7.33
Rot. Bonds10

About [[bis(trimethylsilyloxy)phosphoryl-bis(trimethylsilyl)methyl]-fluorooxyphosphoryl] hypofluorite

[[bis(trimethylsilyloxy)phosphoryl-bis(trimethylsilyl)methyl]-fluorooxyphosphoryl] hypofluorite (PubChem CID 54308904) has the molecular formula C13H36F2O6P2Si4 and a molecular weight of 500.71 g/mol. Its IUPAC name is [[bis(trimethylsilyloxy)phosphoryl-bis(trimethylsilyl)methyl]-fluorooxyphosphoryl] hypofluorite.

Molecular Properties

Compound Name[[bis(trimethylsilyloxy)phosphoryl-bis(trimethylsilyl)methyl]-fluorooxyphosphoryl] hypofluorite
PubChem CID54308904
Molecular FormulaC13H36F2O6P2Si4
Molecular Weight500.71 g/mol
Exact Mass500.10
IUPAC Name[[bis(trimethylsilyloxy)phosphoryl-bis(trimethylsilyl)methyl]-fluorooxyphosphoryl] hypofluorite
SMILESC[Si](C)(C)OP(=O)(O[Si](C)(C)C)C([Si](C)(C)C)([Si](C)(C)C)P(=O)(OF)OF
InChIInChI=1S/C13H36F2O6P2Si4/c1-24(2,3)13(25(4,5)6,22(16,18-14)19-15)23(17,20-26(7,8)9)21-27(10,11)12/h1-12H3
InChIKeySJMPHDDTZWXWKR-UHFFFAOYSA-N
XLogP7.33
TPSA71.06 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms27
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500500.71
LogP ≤ 57.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

C13H36F2O6P2Si4
CID 12722944
Bis(trimethylsilyloxy)phosphoryl bis(trimethylsilyl) phosphate
CID 553982
C13H37FO6P2Si4
CID 12950999
C14H36F4O6P2Si4
CID 10347535
[Fluoro-[fluoro(trimethylsilyloxy)phosphoryl]oxyphosphoryl]oxy-trimethylsilane
CID 12104372
[[Fluorooxy(trimethylsilyloxy)phosphoryl]-bis(trimethylsilyl)methyl]-trimethylsilyloxyphosphinic acid
CID 54468638
[Fluorooxy(trimethylsilyloxy)phosphoryl]methyl-trimethylsilyloxyphosphinic acid
CID 57019616
Bis(trimethylsilyloxy)phosphorylmethyl-fluorooxyphosphinic acid
CID 88714892
Difluorophosphoryl bis(trimethylsilyl) phosphate
CID 157296519
Phosphonic acid, methylenebis-, tetrakis(trimethylsilyl) ester
CID 635053
Bis[bis(trimethylsilyloxy)phosphoryl] trimethylsilyl phosphate
CID 13249622
Thiodiphosphoric acid ((HO)2P(O)OP(O)(OH)(SH)), tetrakis(trimethylsilyl) ester
CID 23420288

Frequently Asked Questions

What is the IUPAC name of [[bis(trimethylsilyloxy)phosphoryl-bis(trimethylsilyl)methyl]-fluorooxyphosphoryl] hypofluorite?
The IUPAC name of [[bis(trimethylsilyloxy)phosphoryl-bis(trimethylsilyl)methyl]-fluorooxyphosphoryl] hypofluorite (CID 54308904) is [[bis(trimethylsilyloxy)phosphoryl-bis(trimethylsilyl)methyl]-fluorooxyphosphoryl] hypofluorite.
What is the SMILES notation for [[bis(trimethylsilyloxy)phosphoryl-bis(trimethylsilyl)methyl]-fluorooxyphosphoryl] hypofluorite?
The canonical SMILES for [[bis(trimethylsilyloxy)phosphoryl-bis(trimethylsilyl)methyl]-fluorooxyphosphoryl] hypofluorite is C[Si](C)(C)OP(=O)(O[Si](C)(C)C)C([Si](C)(C)C)([Si](C)(C)C)P(=O)(OF)OF.
What is the InChIKey of [[bis(trimethylsilyloxy)phosphoryl-bis(trimethylsilyl)methyl]-fluorooxyphosphoryl] hypofluorite?
The InChIKey is SJMPHDDTZWXWKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H36F2O6P2Si4/c1-24(2,3)13(25(4,5)6,22(16,18-14)19-15)23(17,20-26(7,8)9)21-27(10,11)12/h1-12H3.
What are the key properties of [[bis(trimethylsilyloxy)phosphoryl-bis(trimethylsilyl)methyl]-fluorooxyphosphoryl] hypofluorite?
[[bis(trimethylsilyloxy)phosphoryl-bis(trimethylsilyl)methyl]-fluorooxyphosphoryl] hypofluorite has a molecular weight of 500.71 g/mol, XLogP of 7.33, 10 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [[bis(trimethylsilyloxy)phosphoryl-bis(trimethylsilyl)methyl]-fluorooxyphosphoryl] hypofluorite is sourced from PubChem (CID 54308904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).