triethoxy-(2-methoxy-3-propyloxiran-2-yl)silane

C12H26O5Si — CID 141266087

IUPACtriethoxy-(2-methoxy-3-propyloxiran-2-yl)silane
SMILESCCCC1OC1(OC)[Si](OCC)(OCC)OCC
InChIInChI=1S/C12H26O5Si/c1-6-10-11-12(13-5,17-11)18(14-7-2,15-8-3)16-9-4/h11H,6-10H2,1-5H3
InChIKeyCMQOHYBQQJTJRP-UHFFFAOYSA-N
MW278.42 g/mol
LogP2.12
Rot. Bonds10

About triethoxy-(2-methoxy-3-propyloxiran-2-yl)silane

triethoxy-(2-methoxy-3-propyloxiran-2-yl)silane (PubChem CID 141266087) has the molecular formula C12H26O5Si and a molecular weight of 278.42 g/mol. Its IUPAC name is triethoxy-(2-methoxy-3-propyloxiran-2-yl)silane.

Molecular Properties

Compound Nametriethoxy-(2-methoxy-3-propyloxiran-2-yl)silane
PubChem CID141266087
Molecular FormulaC12H26O5Si
Molecular Weight278.42 g/mol
Exact Mass278.15
IUPAC Nametriethoxy-(2-methoxy-3-propyloxiran-2-yl)silane
SMILESCCCC1OC1(OC)[Si](OCC)(OCC)OCC
InChIInChI=1S/C12H26O5Si/c1-6-10-11-12(13-5,17-11)18(14-7-2,15-8-3)16-9-4/h11H,6-10H2,1-5H3
InChIKeyCMQOHYBQQJTJRP-UHFFFAOYSA-N
XLogP2.12
TPSA49.45 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.42
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of triethoxy-(2-methoxy-3-propyloxiran-2-yl)silane?
The IUPAC name of triethoxy-(2-methoxy-3-propyloxiran-2-yl)silane (CID 141266087) is triethoxy-(2-methoxy-3-propyloxiran-2-yl)silane.
What is the SMILES notation for triethoxy-(2-methoxy-3-propyloxiran-2-yl)silane?
The canonical SMILES for triethoxy-(2-methoxy-3-propyloxiran-2-yl)silane is CCCC1OC1(OC)[Si](OCC)(OCC)OCC.
What is the InChIKey of triethoxy-(2-methoxy-3-propyloxiran-2-yl)silane?
The InChIKey is CMQOHYBQQJTJRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26O5Si/c1-6-10-11-12(13-5,17-11)18(14-7-2,15-8-3)16-9-4/h11H,6-10H2,1-5H3.
What are the key properties of triethoxy-(2-methoxy-3-propyloxiran-2-yl)silane?
triethoxy-(2-methoxy-3-propyloxiran-2-yl)silane has a molecular weight of 278.42 g/mol, XLogP of 2.12, 10 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy-(2-methoxy-3-propyloxiran-2-yl)silane is sourced from PubChem (CID 141266087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).