tetrakis[1-hydroxypropyl(dimethyl)silyl] silicate

C20H52O8Si5 — CID 18457504

IUPACtetrakis[1-hydroxypropyl(dimethyl)silyl] silicate
SMILESCCC(O)[Si](C)(C)O[Si](O[Si](C)(C)C(O)CC)(O[Si](C)(C)C(O)CC)O[Si](C)(C)C(O)CC
InChIInChI=1S/C20H52O8Si5/c1-13-17(21)29(5,6)25-33(26-30(7,8)18(22)14-2,27-31(9,10)19(23)15-3)28-32(11,12)20(24)16-4/h17-24H,13-16H2,1-12H3
InChIKeyHMQTWJLPLOTQEC-UHFFFAOYSA-N
MW561.06 g/mol
LogP3.55
Rot. Bonds16

About tetrakis[1-hydroxypropyl(dimethyl)silyl] silicate

tetrakis[1-hydroxypropyl(dimethyl)silyl] silicate (PubChem CID 18457504) has the molecular formula C20H52O8Si5 and a molecular weight of 561.06 g/mol. Its IUPAC name is tetrakis[1-hydroxypropyl(dimethyl)silyl] silicate.

Molecular Properties

Compound Nametetrakis[1-hydroxypropyl(dimethyl)silyl] silicate
PubChem CID18457504
Molecular FormulaC20H52O8Si5
Molecular Weight561.06 g/mol
Exact Mass560.25
IUPAC Nametetrakis[1-hydroxypropyl(dimethyl)silyl] silicate
SMILESCCC(O)[Si](C)(C)O[Si](O[Si](C)(C)C(O)CC)(O[Si](C)(C)C(O)CC)O[Si](C)(C)C(O)CC
InChIInChI=1S/C20H52O8Si5/c1-13-17(21)29(5,6)25-33(26-30(7,8)18(22)14-2,27-31(9,10)19(23)15-3)28-32(11,12)20(24)16-4/h17-24H,13-16H2,1-12H3
InChIKeyHMQTWJLPLOTQEC-UHFFFAOYSA-N
XLogP3.55
TPSA117.84 Ų
H-Bond Donors4
H-Bond Acceptors8
Rotatable Bonds16
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500561.06
LogP ≤ 53.55
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 108

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 tetrakis[1-hydroxypropyl(dimethyl)silyl] silicate?
The IUPAC name of tetrakis[1-hydroxypropyl(dimethyl)silyl] silicate (CID 18457504) is tetrakis[1-hydroxypropyl(dimethyl)silyl] silicate.
What is the SMILES notation for tetrakis[1-hydroxypropyl(dimethyl)silyl] silicate?
The canonical SMILES for tetrakis[1-hydroxypropyl(dimethyl)silyl] silicate is CCC(O)[Si](C)(C)O[Si](O[Si](C)(C)C(O)CC)(O[Si](C)(C)C(O)CC)O[Si](C)(C)C(O)CC.
What is the InChIKey of tetrakis[1-hydroxypropyl(dimethyl)silyl] silicate?
The InChIKey is HMQTWJLPLOTQEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H52O8Si5/c1-13-17(21)29(5,6)25-33(26-30(7,8)18(22)14-2,27-31(9,10)19(23)15-3)28-32(11,12)20(24)16-4/h17-24H,13-16H2,1-12H3.
What are the key properties of tetrakis[1-hydroxypropyl(dimethyl)silyl] silicate?
tetrakis[1-hydroxypropyl(dimethyl)silyl] silicate has a molecular weight of 561.06 g/mol, XLogP of 3.55, 16 rotatable bonds, 4 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for tetrakis[1-hydroxypropyl(dimethyl)silyl] silicate is sourced from PubChem (CID 18457504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).