[3-methoxy-1-(oxiran-2-ylmethoxy)propyl]silane

C7H16O3Si — CID 173269150

IUPAC[3-methoxy-1-(oxiran-2-ylmethoxy)propyl]silane
SMILESCOCCC([SiH3])OCC1CO1
InChIInChI=1S/C7H16O3Si/c1-8-3-2-7(11)10-5-6-4-9-6/h6-7H,2-5H2,1,11H3
InChIKeyVLALWNAPYCKMKN-UHFFFAOYSA-N
MW176.29 g/mol
LogP-0.87
Rot. Bonds6

About [3-methoxy-1-(oxiran-2-ylmethoxy)propyl]silane

[3-methoxy-1-(oxiran-2-ylmethoxy)propyl]silane (PubChem CID 173269150) has the molecular formula C7H16O3Si and a molecular weight of 176.29 g/mol. Its IUPAC name is [3-methoxy-1-(oxiran-2-ylmethoxy)propyl]silane.

Molecular Properties

Compound Name[3-methoxy-1-(oxiran-2-ylmethoxy)propyl]silane
PubChem CID173269150
Molecular FormulaC7H16O3Si
Molecular Weight176.29 g/mol
Exact Mass176.09
IUPAC Name[3-methoxy-1-(oxiran-2-ylmethoxy)propyl]silane
SMILESCOCCC([SiH3])OCC1CO1
InChIInChI=1S/C7H16O3Si/c1-8-3-2-7(11)10-5-6-4-9-6/h6-7H,2-5H2,1,11H3
InChIKeyVLALWNAPYCKMKN-UHFFFAOYSA-N
XLogP-0.87
TPSA30.99 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.29
LogP ≤ 5-0.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[[2-(2-methoxyethoxy)-1-(oxiran-2-yl)ethoxy]methyl]oxirane
CID 87386866
2-(propan-2-yloxymethyl)oxirane
CID 159998967
2-[7-(oxiran-2-ylmethoxy)octan-2-yloxymethyl]oxirane
CID 101275367
2-[1-(oxiran-2-yl)butoxymethyl]oxirane
CID 151610662
2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]oxirane
CID 90384181
2-(1-bromoethoxymethyl)oxirane
CID 20568723
1-(oxiran-2-ylmethoxy)ethanamine
CID 130292873
2-(1-iodoethoxymethyl)oxirane
CID 89194519
dimethoxymethane;bis(2-(methoxymethyl)oxirane)
CID 159900039
(2R)-2-(3-methoxypropoxymethyl)oxirane
CID 130493223
2-(4-methoxybutoxymethyl)oxirane
CID 58151519
CID 158430228
CID 158430228

Frequently Asked Questions

What is the IUPAC name of [3-methoxy-1-(oxiran-2-ylmethoxy)propyl]silane?
The IUPAC name of [3-methoxy-1-(oxiran-2-ylmethoxy)propyl]silane (CID 173269150) is [3-methoxy-1-(oxiran-2-ylmethoxy)propyl]silane.
What is the SMILES notation for [3-methoxy-1-(oxiran-2-ylmethoxy)propyl]silane?
The canonical SMILES for [3-methoxy-1-(oxiran-2-ylmethoxy)propyl]silane is COCCC([SiH3])OCC1CO1.
What is the InChIKey of [3-methoxy-1-(oxiran-2-ylmethoxy)propyl]silane?
The InChIKey is VLALWNAPYCKMKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16O3Si/c1-8-3-2-7(11)10-5-6-4-9-6/h6-7H,2-5H2,1,11H3.
What are the key properties of [3-methoxy-1-(oxiran-2-ylmethoxy)propyl]silane?
[3-methoxy-1-(oxiran-2-ylmethoxy)propyl]silane has a molecular weight of 176.29 g/mol, XLogP of -0.87, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-methoxy-1-(oxiran-2-ylmethoxy)propyl]silane is sourced from PubChem (CID 173269150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).