[2,3,3-trimethoxy-3-(oxiran-2-ylmethoxy)propyl]silane

C9H20O5Si — CID 174398843

IUPAC[2,3,3-trimethoxy-3-(oxiran-2-ylmethoxy)propyl]silane
SMILESCOC(C[SiH3])C(OC)(OC)OCC1CO1
InChIInChI=1S/C9H20O5Si/c1-10-8(6-15)9(11-2,12-3)14-5-7-4-13-7/h7-8H,4-6H2,1-3,15H3
InChIKeyTXSOUFXWPLHEAP-UHFFFAOYSA-N
MW236.34 g/mol
LogP-0.85
Rot. Bonds8

About [2,3,3-trimethoxy-3-(oxiran-2-ylmethoxy)propyl]silane

[2,3,3-trimethoxy-3-(oxiran-2-ylmethoxy)propyl]silane (PubChem CID 174398843) has the molecular formula C9H20O5Si and a molecular weight of 236.34 g/mol. Its IUPAC name is [2,3,3-trimethoxy-3-(oxiran-2-ylmethoxy)propyl]silane.

Molecular Properties

Compound Name[2,3,3-trimethoxy-3-(oxiran-2-ylmethoxy)propyl]silane
PubChem CID174398843
Molecular FormulaC9H20O5Si
Molecular Weight236.34 g/mol
Exact Mass236.11
IUPAC Name[2,3,3-trimethoxy-3-(oxiran-2-ylmethoxy)propyl]silane
SMILESCOC(C[SiH3])C(OC)(OC)OCC1CO1
InChIInChI=1S/C9H20O5Si/c1-10-8(6-15)9(11-2,12-3)14-5-7-4-13-7/h7-8H,4-6H2,1-3,15H3
InChIKeyTXSOUFXWPLHEAP-UHFFFAOYSA-N
XLogP-0.85
TPSA49.45 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.34
LogP ≤ 5-0.85
H-Bond Donors ≤ 50
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'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Related Compounds

2-(1,1-dimethoxypropoxymethyl)oxirane
CID 174508703
2-[[2,4-dimethyl-4-(oxiran-2-ylmethoxy)pentan-2-yl]oxymethyl]oxirane
CID 89152762
[dimethoxy(oxiran-2-ylmethoxy)methyl]-diethoxysilane
CID 175008743
dimethoxymethane;bis(2-(methoxymethyl)oxirane)
CID 159900039
2-(1,1,2-trifluoropropoxymethyl)oxirane
CID 87368360
diiodovanadium;2-(methoxymethyl)oxirane
CID 158509470
[1,1-diethoxy-2-(oxiran-2-ylmethoxy)butyl]silane
CID 173157822
2-[2-methyl-2-[3-methyl-3-(oxiran-2-ylmethoxy)butan-2-yl]oxypropyl]oxirane
CID 123361559
1,1-bis(oxiran-2-ylmethoxy)butane-1,2,2,3,3-pentamine
CID 56622855
2-[3-(1,1,1-trimethoxydecan-2-yloxy)propoxymethyl]oxirane
CID 150291237
methoxy-[3,3,3-tris(oxiran-2-ylmethoxy)propyl]silane
CID 123621626
trimethoxy-[1-(oxiran-2-ylmethoxy)-4-silylbutan-2-yl]silane
CID 175183190

Frequently Asked Questions

What is the IUPAC name of [2,3,3-trimethoxy-3-(oxiran-2-ylmethoxy)propyl]silane?
The IUPAC name of [2,3,3-trimethoxy-3-(oxiran-2-ylmethoxy)propyl]silane (CID 174398843) is [2,3,3-trimethoxy-3-(oxiran-2-ylmethoxy)propyl]silane.
What is the SMILES notation for [2,3,3-trimethoxy-3-(oxiran-2-ylmethoxy)propyl]silane?
The canonical SMILES for [2,3,3-trimethoxy-3-(oxiran-2-ylmethoxy)propyl]silane is COC(C[SiH3])C(OC)(OC)OCC1CO1.
What is the InChIKey of [2,3,3-trimethoxy-3-(oxiran-2-ylmethoxy)propyl]silane?
The InChIKey is TXSOUFXWPLHEAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20O5Si/c1-10-8(6-15)9(11-2,12-3)14-5-7-4-13-7/h7-8H,4-6H2,1-3,15H3.
What are the key properties of [2,3,3-trimethoxy-3-(oxiran-2-ylmethoxy)propyl]silane?
[2,3,3-trimethoxy-3-(oxiran-2-ylmethoxy)propyl]silane has a molecular weight of 236.34 g/mol, XLogP of -0.85, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2,3,3-trimethoxy-3-(oxiran-2-ylmethoxy)propyl]silane is sourced from PubChem (CID 174398843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).