triethoxy-[3-[(2-methylpropan-2-yl)oxy]propyl]silane

C13H30O4Si — CID 175020399

IUPACtriethoxy-[3-[(2-methylpropan-2-yl)oxy]propyl]silane
SMILESCCO[Si](CCCOC(C)(C)C)(OCC)OCC
InChIInChI=1S/C13H30O4Si/c1-7-15-18(16-8-2,17-9-3)12-10-11-14-13(4,5)6/h7-12H2,1-6H3
InChIKeyKFLQQWRGKUJSCI-UHFFFAOYSA-N
MW278.46 g/mol
LogP3.24
Rot. Bonds10

About triethoxy-[3-[(2-methylpropan-2-yl)oxy]propyl]silane

triethoxy-[3-[(2-methylpropan-2-yl)oxy]propyl]silane (PubChem CID 175020399) has the molecular formula C13H30O4Si and a molecular weight of 278.46 g/mol. Its IUPAC name is triethoxy-[3-[(2-methylpropan-2-yl)oxy]propyl]silane.

Molecular Properties

Compound Nametriethoxy-[3-[(2-methylpropan-2-yl)oxy]propyl]silane
PubChem CID175020399
Molecular FormulaC13H30O4Si
Molecular Weight278.46 g/mol
Exact Mass278.19
IUPAC Nametriethoxy-[3-[(2-methylpropan-2-yl)oxy]propyl]silane
SMILESCCO[Si](CCCOC(C)(C)C)(OCC)OCC
InChIInChI=1S/C13H30O4Si/c1-7-15-18(16-8-2,17-9-3)12-10-11-14-13(4,5)6/h7-12H2,1-6H3
InChIKeyKFLQQWRGKUJSCI-UHFFFAOYSA-N
XLogP3.24
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.46
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

triethoxy-[3-(3-triethoxysilylpropoxy)propyl]silane
CID 22616805
triethoxy-[3-[2-(3-triethoxysilylpropoxy)ethoxy]propyl]silane
CID 90147860
triethoxy(3-methoxypropyl)silane
CID 22712922
triethoxy(10-triethoxysilyldecyl)silane
CID 14439044
triethoxy-[3-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctoxy)propyl]silane
CID 71410842
3-(3-triethoxysilylpropoxy)propan-1-amine
CID 54154158
triethoxy(3-thiophosphorosooxypropyl)silane
CID 175204261
butyl(triethoxy)silane;tert-butyl(triethoxy)silane
CID 175188929
dodecyl(triethoxy)silane;tridecane
CID 174970002
triethoxy(henicosyl)silane
CID 141362894
triethoxy(nonyl)silane;triethoxy(octyl)silane
CID 175508301
triethoxy(pentyl)silane;hydrofluoride
CID 174582602

Frequently Asked Questions

What is the IUPAC name of triethoxy-[3-[(2-methylpropan-2-yl)oxy]propyl]silane?
The IUPAC name of triethoxy-[3-[(2-methylpropan-2-yl)oxy]propyl]silane (CID 175020399) is triethoxy-[3-[(2-methylpropan-2-yl)oxy]propyl]silane.
What is the SMILES notation for triethoxy-[3-[(2-methylpropan-2-yl)oxy]propyl]silane?
The canonical SMILES for triethoxy-[3-[(2-methylpropan-2-yl)oxy]propyl]silane is CCO[Si](CCCOC(C)(C)C)(OCC)OCC.
What is the InChIKey of triethoxy-[3-[(2-methylpropan-2-yl)oxy]propyl]silane?
The InChIKey is KFLQQWRGKUJSCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H30O4Si/c1-7-15-18(16-8-2,17-9-3)12-10-11-14-13(4,5)6/h7-12H2,1-6H3.
What are the key properties of triethoxy-[3-[(2-methylpropan-2-yl)oxy]propyl]silane?
triethoxy-[3-[(2-methylpropan-2-yl)oxy]propyl]silane has a molecular weight of 278.46 g/mol, XLogP of 3.24, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy-[3-[(2-methylpropan-2-yl)oxy]propyl]silane is sourced from PubChem (CID 175020399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).