1-(oxiran-2-ylmethoxy)propyl-dipropoxysilane

C12H26O4Si — CID 123534416

IUPAC1-(oxiran-2-ylmethoxy)propyl-dipropoxysilane
SMILESCCCO[SiH](OCCC)C(CC)OCC1CO1
InChIInChI=1S/C12H26O4Si/c1-4-7-15-17(16-8-5-2)12(6-3)14-10-11-9-13-11/h11-12,17H,4-10H2,1-3H3
InChIKeyMXPHAMBNTPOCQK-UHFFFAOYSA-N
MW262.42 g/mol
LogP1.79
Rot. Bonds11

About 1-(oxiran-2-ylmethoxy)propyl-dipropoxysilane

1-(oxiran-2-ylmethoxy)propyl-dipropoxysilane (PubChem CID 123534416) has the molecular formula C12H26O4Si and a molecular weight of 262.42 g/mol. Its IUPAC name is 1-(oxiran-2-ylmethoxy)propyl-dipropoxysilane.

Molecular Properties

Compound Name1-(oxiran-2-ylmethoxy)propyl-dipropoxysilane
PubChem CID123534416
Molecular FormulaC12H26O4Si
Molecular Weight262.42 g/mol
Exact Mass262.16
IUPAC Name1-(oxiran-2-ylmethoxy)propyl-dipropoxysilane
SMILESCCCO[SiH](OCCC)C(CC)OCC1CO1
InChIInChI=1S/C12H26O4Si/c1-4-7-15-17(16-8-5-2)12(6-3)14-10-11-9-13-11/h11-12,17H,4-10H2,1-3H3
InChIKeyMXPHAMBNTPOCQK-UHFFFAOYSA-N
XLogP1.79
TPSA40.22 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.42
LogP ≤ 51.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 1-(oxiran-2-ylmethoxy)propyl-dipropoxysilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

diethoxy-[1-(oxiran-2-ylmethoxy)pentyl]silane
CID 173177487
diethoxy(1-propoxypropyl)silane;hydrate
CID 174935821
2-(propoxymethyl)oxirane
CID 18406
methyl-[1-(oxiran-2-ylmethoxy)ethyl]-dipropoxysilane
CID 54021833
2-(propylperoxymethyl)oxirane
CID 54276351
dibutoxy-[3-(oxiran-2-ylmethoxy)butoxy]silane
CID 175173485
dimethoxy-[3-(oxiran-2-ylmethoxy)pentan-2-yl]silane
CID 173082214
2-[1-(2-propoxyethoxy)propan-2-yloxymethyl]oxirane
CID 134464354
2-(propan-2-yloxymethyl)oxirane
CID 159998967
2-(oxiran-2-ylmethoxy)propyl-tripropoxysilane
CID 22169298
2-[2-(oxiran-2-ylmethoxy)pentan-3-yloxymethyl]oxirane
CID 101275344
2-(1-chlorobutan-2-yloxymethyl)oxirane
CID 58763744

Frequently Asked Questions

What is the IUPAC name of 1-(oxiran-2-ylmethoxy)propyl-dipropoxysilane?
The IUPAC name of 1-(oxiran-2-ylmethoxy)propyl-dipropoxysilane (CID 123534416) is 1-(oxiran-2-ylmethoxy)propyl-dipropoxysilane.
What is the SMILES notation for 1-(oxiran-2-ylmethoxy)propyl-dipropoxysilane?
The canonical SMILES for 1-(oxiran-2-ylmethoxy)propyl-dipropoxysilane is CCCO[SiH](OCCC)C(CC)OCC1CO1.
What is the InChIKey of 1-(oxiran-2-ylmethoxy)propyl-dipropoxysilane?
The InChIKey is MXPHAMBNTPOCQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26O4Si/c1-4-7-15-17(16-8-5-2)12(6-3)14-10-11-9-13-11/h11-12,17H,4-10H2,1-3H3.
What are the key properties of 1-(oxiran-2-ylmethoxy)propyl-dipropoxysilane?
1-(oxiran-2-ylmethoxy)propyl-dipropoxysilane has a molecular weight of 262.42 g/mol, XLogP of 1.79, 11 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(oxiran-2-ylmethoxy)propyl-dipropoxysilane is sourced from PubChem (CID 123534416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).