bis(trimethylsilyloxy)phosphoryl [bis(trimethylsilyloxy)phosphoryloxy-trimethylsilyloxyphosphoryl] trimethylsilyl phosphate

C18H54O13P4Si6 — CID 12781803

IUPACbis(trimethylsilyloxy)phosphoryl [bis(trimethylsilyloxy)phosphoryloxy-trimethylsilyloxyphosphoryl] 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)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C18H54O13P4Si6/c1-36(2,3)26-32(19,24-34(21,28-38(7,8)9)29-39(10,11)12)23-33(20,27-37(4,5)6)25-35(22,30-40(13,14)15)31-41(16,17)18/h1-18H3
InChIKeyRHVIGZLBFCKTFY-UHFFFAOYSA-N
MW771.03 g/mol
LogP10.58
Rot. Bonds18

About bis(trimethylsilyloxy)phosphoryl [bis(trimethylsilyloxy)phosphoryloxy-trimethylsilyloxyphosphoryl] trimethylsilyl phosphate

bis(trimethylsilyloxy)phosphoryl [bis(trimethylsilyloxy)phosphoryloxy-trimethylsilyloxyphosphoryl] trimethylsilyl phosphate (PubChem CID 12781803) has the molecular formula C18H54O13P4Si6 and a molecular weight of 771.03 g/mol. Its IUPAC name is bis(trimethylsilyloxy)phosphoryl [bis(trimethylsilyloxy)phosphoryloxy-trimethylsilyloxyphosphoryl] trimethylsilyl phosphate.

Molecular Properties

Compound Namebis(trimethylsilyloxy)phosphoryl [bis(trimethylsilyloxy)phosphoryloxy-trimethylsilyloxyphosphoryl] trimethylsilyl phosphate
PubChem CID12781803
Molecular FormulaC18H54O13P4Si6
Molecular Weight771.03 g/mol
Exact Mass770.11
IUPAC Namebis(trimethylsilyloxy)phosphoryl [bis(trimethylsilyloxy)phosphoryloxy-trimethylsilyloxyphosphoryl] 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)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C18H54O13P4Si6/c1-36(2,3)26-32(19,24-34(21,28-38(7,8)9)29-39(10,11)12)23-33(20,27-37(4,5)6)25-35(22,30-40(13,14)15)31-41(16,17)18/h1-18H3
InChIKeyRHVIGZLBFCKTFY-UHFFFAOYSA-N
XLogP10.58
TPSA151.35 Ų
H-Bond Donors
H-Bond Acceptors13
Rotatable Bonds18
Heavy Atoms41
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 500771.03
LogP ≤ 510.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1013

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)phosphoryl [bis(trimethylsilyloxy)phosphoryloxy-trimethylsilyloxyphosphoryl] trimethylsilyl phosphate?
The IUPAC name of bis(trimethylsilyloxy)phosphoryl [bis(trimethylsilyloxy)phosphoryloxy-trimethylsilyloxyphosphoryl] trimethylsilyl phosphate (CID 12781803) is bis(trimethylsilyloxy)phosphoryl [bis(trimethylsilyloxy)phosphoryloxy-trimethylsilyloxyphosphoryl] trimethylsilyl phosphate.
What is the SMILES notation for bis(trimethylsilyloxy)phosphoryl [bis(trimethylsilyloxy)phosphoryloxy-trimethylsilyloxyphosphoryl] trimethylsilyl phosphate?
The canonical SMILES for bis(trimethylsilyloxy)phosphoryl [bis(trimethylsilyloxy)phosphoryloxy-trimethylsilyloxyphosphoryl] 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)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C.
What is the InChIKey of bis(trimethylsilyloxy)phosphoryl [bis(trimethylsilyloxy)phosphoryloxy-trimethylsilyloxyphosphoryl] trimethylsilyl phosphate?
The InChIKey is RHVIGZLBFCKTFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H54O13P4Si6/c1-36(2,3)26-32(19,24-34(21,28-38(7,8)9)29-39(10,11)12)23-33(20,27-37(4,5)6)25-35(22,30-40(13,14)15)31-41(16,17)18/h1-18H3.
What are the key properties of bis(trimethylsilyloxy)phosphoryl [bis(trimethylsilyloxy)phosphoryloxy-trimethylsilyloxyphosphoryl] trimethylsilyl phosphate?
bis(trimethylsilyloxy)phosphoryl [bis(trimethylsilyloxy)phosphoryloxy-trimethylsilyloxyphosphoryl] trimethylsilyl phosphate has a molecular weight of 771.03 g/mol, XLogP of 10.58, 18 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for bis(trimethylsilyloxy)phosphoryl [bis(trimethylsilyloxy)phosphoryloxy-trimethylsilyloxyphosphoryl] trimethylsilyl phosphate is sourced from PubChem (CID 12781803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).