bis[bis(trimethylsilyloxy)phosphoryl] trimethylsilyl phosphate

C15H45O10P3Si5 — CID 13249622

IUPACbis[bis(trimethylsilyloxy)phosphoryl] trimethylsilyl phosphate
SMILESC[Si](C)(C)OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C15H45O10P3Si5/c1-29(2,3)21-26(16,19-27(17,22-30(4,5)6)23-31(7,8)9)20-28(18,24-32(10,11)12)25-33(13,14)15/h1-15H3
InChIKeyHIBPKTCYTJWWPM-UHFFFAOYSA-N
MW618.87 g/mol
LogP8.60
Rot. Bonds14

About bis[bis(trimethylsilyloxy)phosphoryl] trimethylsilyl phosphate

bis[bis(trimethylsilyloxy)phosphoryl] trimethylsilyl phosphate (PubChem CID 13249622) has the molecular formula C15H45O10P3Si5 and a molecular weight of 618.87 g/mol. Its IUPAC name is bis[bis(trimethylsilyloxy)phosphoryl] trimethylsilyl phosphate.

Molecular Properties

Compound Namebis[bis(trimethylsilyloxy)phosphoryl] trimethylsilyl phosphate
PubChem CID13249622
Molecular FormulaC15H45O10P3Si5
Molecular Weight618.87 g/mol
Exact Mass618.11
IUPAC Namebis[bis(trimethylsilyloxy)phosphoryl] trimethylsilyl phosphate
SMILESC[Si](C)(C)OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C15H45O10P3Si5/c1-29(2,3)21-26(16,19-27(17,22-30(4,5)6)23-31(7,8)9)20-28(18,24-32(10,11)12)25-33(13,14)15/h1-15H3
InChIKeyHIBPKTCYTJWWPM-UHFFFAOYSA-N
XLogP8.60
TPSA115.82 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds14
Heavy Atoms33
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500618.87
LogP ≤ 58.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

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

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Related Compounds

Tris(trimethylsilyl) phosphate
CID 25317
Bis(trimethylsilyloxy)phosphoryl bis(trimethylsilyl) phosphate
CID 553982
C13H37FO6P2Si4
CID 12950999
Trimethyl-[[2,4,6,8-tetraoxo-4,6,8-tris(trimethylsilyloxy)-1,3,5,7,2lambda5,4lambda5,6lambda5,8lambda5-tetraoxatetraphosphocan-2-yl]oxy]silane
CID 12781801
[[Bis(trimethylsilyloxy)phosphoryl-bis(trimethylsilyl)methyl]-fluorooxyphosphoryl] hypofluorite
CID 54308904
[[Fluorooxy(trimethylsilyloxy)phosphoryl]-bis(trimethylsilyl)methyl]-trimethylsilyloxyphosphinic acid
CID 54468638
Phosphonic acid, methylenebis-, tetrakis(trimethylsilyl) ester
CID 635053
Bis(trimethylsilyl) [2,4,6-trioxo-4,6-bis(trimethylsilyloxy)-1,3,5,2lambda5,4lambda5,6lambda5-trioxatriphosphinan-2-yl] phosphate
CID 12781802
Bis(trimethylsilyloxy)phosphoryl [bis(trimethylsilyloxy)phosphoryloxy-trimethylsilyloxyphosphoryl] trimethylsilyl phosphate
CID 12781803
Bis(trimethylsilyloxy)phosphoryl [[hydroxy(trimethylsilyloxy)phosphoryl]oxy-trimethylsilyloxyphosphoryl] phosphate
CID 178341290
Thiodiphosphoric acid ((HO)2P(O)OP(O)(OH)(SH)), tetrakis(trimethylsilyl) ester
CID 23420288
Oxo-bis[tris(trimethylsilyloxy)silyloxy]phosphanium
CID 87716434

Frequently Asked Questions

What is the IUPAC name of bis[bis(trimethylsilyloxy)phosphoryl] trimethylsilyl phosphate?
The IUPAC name of bis[bis(trimethylsilyloxy)phosphoryl] trimethylsilyl phosphate (CID 13249622) is bis[bis(trimethylsilyloxy)phosphoryl] trimethylsilyl phosphate.
What is the SMILES notation for bis[bis(trimethylsilyloxy)phosphoryl] trimethylsilyl phosphate?
The canonical SMILES for bis[bis(trimethylsilyloxy)phosphoryl] trimethylsilyl phosphate is C[Si](C)(C)OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C.
What is the InChIKey of bis[bis(trimethylsilyloxy)phosphoryl] trimethylsilyl phosphate?
The InChIKey is HIBPKTCYTJWWPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H45O10P3Si5/c1-29(2,3)21-26(16,19-27(17,22-30(4,5)6)23-31(7,8)9)20-28(18,24-32(10,11)12)25-33(13,14)15/h1-15H3.
What are the key properties of bis[bis(trimethylsilyloxy)phosphoryl] trimethylsilyl phosphate?
bis[bis(trimethylsilyloxy)phosphoryl] trimethylsilyl phosphate has a molecular weight of 618.87 g/mol, XLogP of 8.60, 14 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for bis[bis(trimethylsilyloxy)phosphoryl] trimethylsilyl phosphate is sourced from PubChem (CID 13249622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).