propane-1,2,3-triol;triethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane

C15H34O8Si — CID 174916618

IUPACpropane-1,2,3-triol;triethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane
SMILESCCO[Si](CCCOCC1CO1)(OCC)OCC.OCC(O)CO
InChIInChI=1S/C12H26O5Si.C3H8O3/c1-4-15-18(16-5-2,17-6-3)9-7-8-13-10-12-11-14-12;4-1-3(6)2-5/h12H,4-11H2,1-3H3;3-6H,1-2H2
InChIKeyFSBWNHYHIGBZEH-UHFFFAOYSA-N
MW370.52 g/mol
LogP0.17
Rot. Bonds14

About propane-1,2,3-triol;triethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane

propane-1,2,3-triol;triethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane (PubChem CID 174916618) has the molecular formula C15H34O8Si and a molecular weight of 370.52 g/mol. Its IUPAC name is propane-1,2,3-triol;triethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane.

Molecular Properties

Compound Namepropane-1,2,3-triol;triethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane
PubChem CID174916618
Molecular FormulaC15H34O8Si
Molecular Weight370.52 g/mol
Exact Mass370.20
IUPAC Namepropane-1,2,3-triol;triethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane
SMILESCCO[Si](CCCOCC1CO1)(OCC)OCC.OCC(O)CO
InChIInChI=1S/C12H26O5Si.C3H8O3/c1-4-15-18(16-5-2,17-6-3)9-7-8-13-10-12-11-14-12;4-1-3(6)2-5/h12H,4-11H2,1-3H3;3-6H,1-2H2
InChIKeyFSBWNHYHIGBZEH-UHFFFAOYSA-N
XLogP0.17
TPSA110.14 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds14
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.52
LogP ≤ 50.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Related Compounds

2-[ethoxy-(2-hydroxyethoxy)-[3-(oxiran-2-ylmethoxy)propyl]silyl]oxyethanol
CID 87723371
propane-1-thiol;triethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane
CID 174889951
2-(octadecoxymethyl)oxirane;bis(propane-1,2,3-triol)
CID 19926009
diethoxy-methyl-[1-(oxiran-2-ylmethoxy)propyl]silane;triethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane
CID 87666631
propyl 2-methylprop-2-enoate;triethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane
CID 174676531
2-(5-methylheptoxymethyl)oxirane;propane-1,2,3-triol
CID 174940930
silane;triethoxy-[3-(oxiran-2-ylmethylperoxy)propyl]silane
CID 173126681
2-(oxiran-2-ylmethoxymethyl)oxirane;silane;3-triethoxysilylpropan-1-amine
CID 174864417
triethoxy-[3-[3-[3-(oxiran-2-ylmethoxy)propyl]imidazolidin-1-yl]propyl]silane
CID 140960756
2-(oxiran-2-ylmethoxymethyl)oxirane;bis(propane-1,2,3-triol)
CID 23284067
diethoxy-[2-(oxiran-2-ylmethoxy)butyl]silane;triethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane
CID 173010804
butan-2-one;trimethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane
CID 174775957

Frequently Asked Questions

What is the IUPAC name of propane-1,2,3-triol;triethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane?
The IUPAC name of propane-1,2,3-triol;triethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane (CID 174916618) is propane-1,2,3-triol;triethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane.
What is the SMILES notation for propane-1,2,3-triol;triethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane?
The canonical SMILES for propane-1,2,3-triol;triethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane is CCO[Si](CCCOCC1CO1)(OCC)OCC.OCC(O)CO.
What is the InChIKey of propane-1,2,3-triol;triethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane?
The InChIKey is FSBWNHYHIGBZEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26O5Si.C3H8O3/c1-4-15-18(16-5-2,17-6-3)9-7-8-13-10-12-11-14-12;4-1-3(6)2-5/h12H,4-11H2,1-3H3;3-6H,1-2H2.
What are the key properties of propane-1,2,3-triol;triethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane?
propane-1,2,3-triol;triethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane has a molecular weight of 370.52 g/mol, XLogP of 0.17, 14 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for propane-1,2,3-triol;triethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane is sourced from PubChem (CID 174916618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).