1-ethoxy-2-triethoxysilylethanol

C10H24O5Si — CID 87970576

IUPAC1-ethoxy-2-triethoxysilylethanol
SMILESCCOC(O)C[Si](OCC)(OCC)OCC
InChIInChI=1S/C10H24O5Si/c1-5-12-10(11)9-16(13-6-2,14-7-3)15-8-4/h10-11H,5-9H2,1-4H3
InChIKeySMJGOJJILXEKJL-UHFFFAOYSA-N
MW252.38 g/mol
LogP1.39
Rot. Bonds10

About 1-ethoxy-2-triethoxysilylethanol

1-ethoxy-2-triethoxysilylethanol (PubChem CID 87970576) has the molecular formula C10H24O5Si and a molecular weight of 252.38 g/mol. Its IUPAC name is 1-ethoxy-2-triethoxysilylethanol.

Molecular Properties

Compound Name1-ethoxy-2-triethoxysilylethanol
PubChem CID87970576
Molecular FormulaC10H24O5Si
Molecular Weight252.38 g/mol
Exact Mass252.14
IUPAC Name1-ethoxy-2-triethoxysilylethanol
SMILESCCOC(O)C[Si](OCC)(OCC)OCC
InChIInChI=1S/C10H24O5Si/c1-5-12-10(11)9-16(13-6-2,14-7-3)15-8-4/h10-11H,5-9H2,1-4H3
InChIKeySMJGOJJILXEKJL-UHFFFAOYSA-N
XLogP1.39
TPSA57.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.38
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

3-triethoxysilylpropane-1,2-diol
CID 87668140
1-triethoxysilylpropan-2-amine
CID 10236113
triethoxy-(3-ethyl-2-methylpentyl)silane
CID 18696416
1-ethoxybutane-1,3-diol
CID 20870845
(3,4-dichloro-2,5-dimethylhexyl)-triethoxysilane
CID 91420779
triethoxy(2-heptylundecyl)silane
CID 139707869
2-(2-aminoethylamino)-1-ethoxyethanol
CID 57110947
1-[1,2-dihydroxypropyl(triethoxysilylmethyl)amino]propane-1,2-diol
CID 142761773
1-ethoxy-3-methylsulfanylpropan-1-ol
CID 143477996
1-triethoxysilylheptan-2-amine
CID 90410833
[methyl-di(propan-2-yl)silyl] 2-methyl-3-triethoxysilylpropanoate
CID 151495490
CID 159597367
CID 159597367

Frequently Asked Questions

What is the IUPAC name of 1-ethoxy-2-triethoxysilylethanol?
The IUPAC name of 1-ethoxy-2-triethoxysilylethanol (CID 87970576) is 1-ethoxy-2-triethoxysilylethanol.
What is the SMILES notation for 1-ethoxy-2-triethoxysilylethanol?
The canonical SMILES for 1-ethoxy-2-triethoxysilylethanol is CCOC(O)C[Si](OCC)(OCC)OCC.
What is the InChIKey of 1-ethoxy-2-triethoxysilylethanol?
The InChIKey is SMJGOJJILXEKJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24O5Si/c1-5-12-10(11)9-16(13-6-2,14-7-3)15-8-4/h10-11H,5-9H2,1-4H3.
What are the key properties of 1-ethoxy-2-triethoxysilylethanol?
1-ethoxy-2-triethoxysilylethanol has a molecular weight of 252.38 g/mol, XLogP of 1.39, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxy-2-triethoxysilylethanol is sourced from PubChem (CID 87970576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).