propan-2-yl bis(trimethylsilyl) tris(trimethylsilyloxy)silyl silicate

C18H52O7Si7 — CID 553025

IUPACpropan-2-yl bis(trimethylsilyl) tris(trimethylsilyloxy)silyl silicate
SMILESCC(C)O[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C18H52O7Si7/c1-18(2)19-31(20-26(3,4)5,21-27(6,7)8)25-32(22-28(9,10)11,23-29(12,13)14)24-30(15,16)17/h18H,1-17H3
InChIKeyMODCFEJKGWZWCR-UHFFFAOYSA-N
MW577.21 g/mol
LogP6.56
Rot. Bonds14

About propan-2-yl bis(trimethylsilyl) tris(trimethylsilyloxy)silyl silicate

propan-2-yl bis(trimethylsilyl) tris(trimethylsilyloxy)silyl silicate (PubChem CID 553025) has the molecular formula C18H52O7Si7 and a molecular weight of 577.21 g/mol. Its IUPAC name is propan-2-yl bis(trimethylsilyl) tris(trimethylsilyloxy)silyl silicate.

Molecular Properties

Compound Namepropan-2-yl bis(trimethylsilyl) tris(trimethylsilyloxy)silyl silicate
PubChem CID553025
Molecular FormulaC18H52O7Si7
Molecular Weight577.21 g/mol
Exact Mass576.21
IUPAC Namepropan-2-yl bis(trimethylsilyl) tris(trimethylsilyloxy)silyl silicate
SMILESCC(C)O[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C18H52O7Si7/c1-18(2)19-31(20-26(3,4)5,21-27(6,7)8)25-32(22-28(9,10)11,23-29(12,13)14)24-30(15,16)17/h18H,1-17H3
InChIKeyMODCFEJKGWZWCR-UHFFFAOYSA-N
XLogP6.56
TPSA64.61 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds14
Heavy Atoms32
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500577.21
LogP ≤ 56.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of propan-2-yl bis(trimethylsilyl) tris(trimethylsilyloxy)silyl silicate?
The IUPAC name of propan-2-yl bis(trimethylsilyl) tris(trimethylsilyloxy)silyl silicate (CID 553025) is propan-2-yl bis(trimethylsilyl) tris(trimethylsilyloxy)silyl silicate.
What is the SMILES notation for propan-2-yl bis(trimethylsilyl) tris(trimethylsilyloxy)silyl silicate?
The canonical SMILES for propan-2-yl bis(trimethylsilyl) tris(trimethylsilyloxy)silyl silicate is CC(C)O[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C.
What is the InChIKey of propan-2-yl bis(trimethylsilyl) tris(trimethylsilyloxy)silyl silicate?
The InChIKey is MODCFEJKGWZWCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H52O7Si7/c1-18(2)19-31(20-26(3,4)5,21-27(6,7)8)25-32(22-28(9,10)11,23-29(12,13)14)24-30(15,16)17/h18H,1-17H3.
What are the key properties of propan-2-yl bis(trimethylsilyl) tris(trimethylsilyloxy)silyl silicate?
propan-2-yl bis(trimethylsilyl) tris(trimethylsilyloxy)silyl silicate has a molecular weight of 577.21 g/mol, XLogP of 6.56, 14 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for propan-2-yl bis(trimethylsilyl) tris(trimethylsilyloxy)silyl silicate is sourced from PubChem (CID 553025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).