tetrakis[(3-ethyloxetan-3-yl)methyl] silicate

C24H44O8Si — CID 22098089

IUPACtetrakis[(3-ethyloxetan-3-yl)methyl] silicate
SMILESCCC1(CO[Si](OCC2(CC)COC2)(OCC2(CC)COC2)OCC2(CC)COC2)COC1
InChIInChI=1S/C24H44O8Si/c1-5-21(9-25-10-21)17-29-33(30-18-22(6-2)11-26-12-22,31-19-23(7-3)13-27-14-23)32-20-24(8-4)15-28-16-24/h5-20H2,1-4H3
InChIKeyFFTGRCQNMCNIGQ-UHFFFAOYSA-N
MW488.69 g/mol
LogP3.19
Rot. Bonds16

About tetrakis[(3-ethyloxetan-3-yl)methyl] silicate

tetrakis[(3-ethyloxetan-3-yl)methyl] silicate (PubChem CID 22098089) has the molecular formula C24H44O8Si and a molecular weight of 488.69 g/mol. Its IUPAC name is tetrakis[(3-ethyloxetan-3-yl)methyl] silicate.

Molecular Properties

Compound Nametetrakis[(3-ethyloxetan-3-yl)methyl] silicate
PubChem CID22098089
Molecular FormulaC24H44O8Si
Molecular Weight488.69 g/mol
Exact Mass488.28
IUPAC Nametetrakis[(3-ethyloxetan-3-yl)methyl] silicate
SMILESCCC1(CO[Si](OCC2(CC)COC2)(OCC2(CC)COC2)OCC2(CC)COC2)COC1
InChIInChI=1S/C24H44O8Si/c1-5-21(9-25-10-21)17-29-33(30-18-22(6-2)11-26-12-22,31-19-23(7-3)13-27-14-23)32-20-24(8-4)15-28-16-24/h5-20H2,1-4H3
InChIKeyFFTGRCQNMCNIGQ-UHFFFAOYSA-N
XLogP3.19
TPSA73.84 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds16
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500488.69
LogP ≤ 53.19
H-Bond Donors ≤ 50
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[(3-ethyloxetan-3-yl)methyl] silicate?
The IUPAC name of tetrakis[(3-ethyloxetan-3-yl)methyl] silicate (CID 22098089) is tetrakis[(3-ethyloxetan-3-yl)methyl] silicate.
What is the SMILES notation for tetrakis[(3-ethyloxetan-3-yl)methyl] silicate?
The canonical SMILES for tetrakis[(3-ethyloxetan-3-yl)methyl] silicate is CCC1(CO[Si](OCC2(CC)COC2)(OCC2(CC)COC2)OCC2(CC)COC2)COC1.
What is the InChIKey of tetrakis[(3-ethyloxetan-3-yl)methyl] silicate?
The InChIKey is FFTGRCQNMCNIGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H44O8Si/c1-5-21(9-25-10-21)17-29-33(30-18-22(6-2)11-26-12-22,31-19-23(7-3)13-27-14-23)32-20-24(8-4)15-28-16-24/h5-20H2,1-4H3.
What are the key properties of tetrakis[(3-ethyloxetan-3-yl)methyl] silicate?
tetrakis[(3-ethyloxetan-3-yl)methyl] silicate has a molecular weight of 488.69 g/mol, XLogP of 3.19, 16 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for tetrakis[(3-ethyloxetan-3-yl)methyl] silicate is sourced from PubChem (CID 22098089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).