bis[tert-butyl(dimethyl)silyl] ethyl phosphate;[tert-butyl(dimethyl)silyl] ethyl trimethylsilyl phosphate;trimethyl-[methyl(trimethylsilyloxy)phosphoryl]oxysilane

C32H85O11P3Si6 — CID 159477136

IUPACbis[tert-butyl(dimethyl)silyl] ethyl phosphate;[tert-butyl(dimethyl)silyl] ethyl trimethylsilyl phosphate;trimethyl-[methyl(trimethylsilyloxy)phosphoryl]oxysilane
SMILESCCOP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C.CCOP(=O)(O[Si](C)(C)C)O[Si](C)(C)C(C)(C)C.C[Si](C)(C)OP(C)(=O)O[Si](C)(C)C
InChIInChI=1S/C14H35O4PSi2.C11H29O4PSi2.C7H21O3PSi2/c1-12-16-19(15,17-20(8,9)13(2,3)4)18-21(10,11)14(5,6)7;1-10-13-16(12,14-17(5,6)7)15-18(8,9)11(2,3)4;1-11(8,9-12(2,3)4)10-13(5,6)7/h12H2,1-11H3;10H2,1-9H3;1-7H3
InChIKeyLWNFTVPMMKNERL-UHFFFAOYSA-N
MW907.46 g/mol
LogP14.69
Rot. Bonds16

About bis[tert-butyl(dimethyl)silyl] ethyl phosphate;[tert-butyl(dimethyl)silyl] ethyl trimethylsilyl phosphate;trimethyl-[methyl(trimethylsilyloxy)phosphoryl]oxysilane

bis[tert-butyl(dimethyl)silyl] ethyl phosphate;[tert-butyl(dimethyl)silyl] ethyl trimethylsilyl phosphate;trimethyl-[methyl(trimethylsilyloxy)phosphoryl]oxysilane (PubChem CID 159477136) has the molecular formula C32H85O11P3Si6 and a molecular weight of 907.46 g/mol. Its IUPAC name is bis[tert-butyl(dimethyl)silyl] ethyl phosphate;[tert-butyl(dimethyl)silyl] ethyl trimethylsilyl phosphate;trimethyl-[methyl(trimethylsilyloxy)phosphoryl]oxysilane.

Molecular Properties

Compound Namebis[tert-butyl(dimethyl)silyl] ethyl phosphate;[tert-butyl(dimethyl)silyl] ethyl trimethylsilyl phosphate;trimethyl-[methyl(trimethylsilyloxy)phosphoryl]oxysilane
PubChem CID159477136
Molecular FormulaC32H85O11P3Si6
Molecular Weight907.46 g/mol
Exact Mass906.39
IUPAC Namebis[tert-butyl(dimethyl)silyl] ethyl phosphate;[tert-butyl(dimethyl)silyl] ethyl trimethylsilyl phosphate;trimethyl-[methyl(trimethylsilyloxy)phosphoryl]oxysilane
SMILESCCOP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C.CCOP(=O)(O[Si](C)(C)C)O[Si](C)(C)C(C)(C)C.C[Si](C)(C)OP(C)(=O)O[Si](C)(C)C
InChIInChI=1S/C14H35O4PSi2.C11H29O4PSi2.C7H21O3PSi2/c1-12-16-19(15,17-20(8,9)13(2,3)4)18-21(10,11)14(5,6)7;1-10-13-16(12,14-17(5,6)7)15-18(8,9)11(2,3)4;1-11(8,9-12(2,3)4)10-13(5,6)7/h12H2,1-11H3;10H2,1-9H3;1-7H3
InChIKeyLWNFTVPMMKNERL-UHFFFAOYSA-N
XLogP14.69
TPSA125.05 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds16
Heavy Atoms52
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 500907.46
LogP ≤ 514.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Computed Properties (RDKit)

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

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Related Compounds

ethyl trimethylsilyl hydrogen phosphate
CID 19079822
[4-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl] diethyl phosphate
CID 59859472
prop-2-enyl (2S)-2-[tert-butyl(dimethyl)silyl]oxy-3-diethoxyphosphoryloxypropanoate
CID 101138901
(3-diethoxyphosphoryloxy-2,2-dimethylpropyl) diethyl phosphate
CID 518173
tert-butyl-(1-diethoxyphosphorylcyclopropyl)-dimethylsilane
CID 99771569
methane;[methoxy(methyl)phosphoryl]oxy-trimethylsilane
CID 158342684
diethyl [methoxy(methyl)phosphoryl] phosphate
CID 162624062
tert-butyl-[1-[ethoxy(ethyl)phosphoryl]oxyprop-2-enoxy]-dimethylsilane
CID 57238883
trimethyl-[methyl(3-methylpentoxy)phosphoryl]oxysilane
CID 91721359
trimethyl-[methyl(3-methylbutoxy)phosphoryl]oxysilane
CID 91752262
hexadecakis(oxygen(2-));rhenium;thorium(4+);tetrakis(triethyl phosphate)
CID 139152951
triethyl phosphate;bis(trimethylsilane)
CID 175760856

Frequently Asked Questions

What is the IUPAC name of bis[tert-butyl(dimethyl)silyl] ethyl phosphate;[tert-butyl(dimethyl)silyl] ethyl trimethylsilyl phosphate;trimethyl-[methyl(trimethylsilyloxy)phosphoryl]oxysilane?
The IUPAC name of bis[tert-butyl(dimethyl)silyl] ethyl phosphate;[tert-butyl(dimethyl)silyl] ethyl trimethylsilyl phosphate;trimethyl-[methyl(trimethylsilyloxy)phosphoryl]oxysilane (CID 159477136) is bis[tert-butyl(dimethyl)silyl] ethyl phosphate;[tert-butyl(dimethyl)silyl] ethyl trimethylsilyl phosphate;trimethyl-[methyl(trimethylsilyloxy)phosphoryl]oxysilane.
What is the SMILES notation for bis[tert-butyl(dimethyl)silyl] ethyl phosphate;[tert-butyl(dimethyl)silyl] ethyl trimethylsilyl phosphate;trimethyl-[methyl(trimethylsilyloxy)phosphoryl]oxysilane?
The canonical SMILES for bis[tert-butyl(dimethyl)silyl] ethyl phosphate;[tert-butyl(dimethyl)silyl] ethyl trimethylsilyl phosphate;trimethyl-[methyl(trimethylsilyloxy)phosphoryl]oxysilane is CCOP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C.CCOP(=O)(O[Si](C)(C)C)O[Si](C)(C)C(C)(C)C.C[Si](C)(C)OP(C)(=O)O[Si](C)(C)C.
What is the InChIKey of bis[tert-butyl(dimethyl)silyl] ethyl phosphate;[tert-butyl(dimethyl)silyl] ethyl trimethylsilyl phosphate;trimethyl-[methyl(trimethylsilyloxy)phosphoryl]oxysilane?
The InChIKey is LWNFTVPMMKNERL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H35O4PSi2.C11H29O4PSi2.C7H21O3PSi2/c1-12-16-19(15,17-20(8,9)13(2,3)4)18-21(10,11)14(5,6)7;1-10-13-16(12,14-17(5,6)7)15-18(8,9)11(2,3)4;1-11(8,9-12(2,3)4)10-13(5,6)7/h12H2,1-11H3;10H2,1-9H3;1-7H3.
What are the key properties of bis[tert-butyl(dimethyl)silyl] ethyl phosphate;[tert-butyl(dimethyl)silyl] ethyl trimethylsilyl phosphate;trimethyl-[methyl(trimethylsilyloxy)phosphoryl]oxysilane?
bis[tert-butyl(dimethyl)silyl] ethyl phosphate;[tert-butyl(dimethyl)silyl] ethyl trimethylsilyl phosphate;trimethyl-[methyl(trimethylsilyloxy)phosphoryl]oxysilane has a molecular weight of 907.46 g/mol, XLogP of 14.69, 16 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for bis[tert-butyl(dimethyl)silyl] ethyl phosphate;[tert-butyl(dimethyl)silyl] ethyl trimethylsilyl phosphate;trimethyl-[methyl(trimethylsilyloxy)phosphoryl]oxysilane is sourced from PubChem (CID 159477136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).