bis(trimethylsilyloxy)phosphorylmethyl-fluorooxyphosphinic acid

C7H21FO6P2Si2 — CID 88714892

IUPACbis(trimethylsilyloxy)phosphorylmethyl-fluorooxyphosphinic acid
SMILESC[Si](C)(C)OP(=O)(CP(=O)(O)OF)O[Si](C)(C)C
InChIInChI=1S/C7H21FO6P2Si2/c1-17(2,3)13-16(11,14-18(4,5)6)7-15(9,10)12-8/h7H2,1-6H3,(H,9,10)
InChIKeySZAQNHGUSIBRMI-UHFFFAOYSA-N
MW338.36 g/mol
LogP3.93
Rot. Bonds7

About bis(trimethylsilyloxy)phosphorylmethyl-fluorooxyphosphinic acid

bis(trimethylsilyloxy)phosphorylmethyl-fluorooxyphosphinic acid (PubChem CID 88714892) has the molecular formula C7H21FO6P2Si2 and a molecular weight of 338.36 g/mol. Its IUPAC name is bis(trimethylsilyloxy)phosphorylmethyl-fluorooxyphosphinic acid.

Molecular Properties

Compound Namebis(trimethylsilyloxy)phosphorylmethyl-fluorooxyphosphinic acid
PubChem CID88714892
Molecular FormulaC7H21FO6P2Si2
Molecular Weight338.36 g/mol
Exact Mass338.03
IUPAC Namebis(trimethylsilyloxy)phosphorylmethyl-fluorooxyphosphinic acid
SMILESC[Si](C)(C)OP(=O)(CP(=O)(O)OF)O[Si](C)(C)C
InChIInChI=1S/C7H21FO6P2Si2/c1-17(2,3)13-16(11,14-18(4,5)6)7-15(9,10)12-8/h7H2,1-6H3,(H,9,10)
InChIKeySZAQNHGUSIBRMI-UHFFFAOYSA-N
XLogP3.93
TPSA82.06 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.36
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of bis(trimethylsilyloxy)phosphorylmethyl-fluorooxyphosphinic acid?
The IUPAC name of bis(trimethylsilyloxy)phosphorylmethyl-fluorooxyphosphinic acid (CID 88714892) is bis(trimethylsilyloxy)phosphorylmethyl-fluorooxyphosphinic acid.
What is the SMILES notation for bis(trimethylsilyloxy)phosphorylmethyl-fluorooxyphosphinic acid?
The canonical SMILES for bis(trimethylsilyloxy)phosphorylmethyl-fluorooxyphosphinic acid is C[Si](C)(C)OP(=O)(CP(=O)(O)OF)O[Si](C)(C)C.
What is the InChIKey of bis(trimethylsilyloxy)phosphorylmethyl-fluorooxyphosphinic acid?
The InChIKey is SZAQNHGUSIBRMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H21FO6P2Si2/c1-17(2,3)13-16(11,14-18(4,5)6)7-15(9,10)12-8/h7H2,1-6H3,(H,9,10).
What are the key properties of bis(trimethylsilyloxy)phosphorylmethyl-fluorooxyphosphinic acid?
bis(trimethylsilyloxy)phosphorylmethyl-fluorooxyphosphinic acid has a molecular weight of 338.36 g/mol, XLogP of 3.93, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for bis(trimethylsilyloxy)phosphorylmethyl-fluorooxyphosphinic acid is sourced from PubChem (CID 88714892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).