3-[2-[[dimethyl(1-trimethoxysilylethyl)silyl]oxy-dimethylsilyl]propyl]oxolane-2,5-dione

C16H34O7Si3 — CID 89274552

IUPAC3-[2-[[dimethyl(1-trimethoxysilylethyl)silyl]oxy-dimethylsilyl]propyl]oxolane-2,5-dione
SMILESCO[Si](OC)(OC)C(C)[Si](C)(C)O[Si](C)(C)C(C)CC1CC(=O)OC1=O
InChIInChI=1S/C16H34O7Si3/c1-12(10-14-11-15(17)22-16(14)18)24(6,7)23-25(8,9)13(2)26(19-3,20-4)21-5/h12-14H,10-11H2,1-9H3
InChIKeyFOCRNVXGVBDMBA-UHFFFAOYSA-N
MW422.70 g/mol
LogP3.09
Rot. Bonds10

About 3-[2-[[dimethyl(1-trimethoxysilylethyl)silyl]oxy-dimethylsilyl]propyl]oxolane-2,5-dione

3-[2-[[dimethyl(1-trimethoxysilylethyl)silyl]oxy-dimethylsilyl]propyl]oxolane-2,5-dione (PubChem CID 89274552) has the molecular formula C16H34O7Si3 and a molecular weight of 422.70 g/mol. Its IUPAC name is 3-[2-[[dimethyl(1-trimethoxysilylethyl)silyl]oxy-dimethylsilyl]propyl]oxolane-2,5-dione.

Molecular Properties

Compound Name3-[2-[[dimethyl(1-trimethoxysilylethyl)silyl]oxy-dimethylsilyl]propyl]oxolane-2,5-dione
PubChem CID89274552
Molecular FormulaC16H34O7Si3
Molecular Weight422.70 g/mol
Exact Mass422.16
IUPAC Name3-[2-[[dimethyl(1-trimethoxysilylethyl)silyl]oxy-dimethylsilyl]propyl]oxolane-2,5-dione
SMILESCO[Si](OC)(OC)C(C)[Si](C)(C)O[Si](C)(C)C(C)CC1CC(=O)OC1=O
InChIInChI=1S/C16H34O7Si3/c1-12(10-14-11-15(17)22-16(14)18)24(6,7)23-25(8,9)13(2)26(19-3,20-4)21-5/h12-14H,10-11H2,1-9H3
InChIKeyFOCRNVXGVBDMBA-UHFFFAOYSA-N
XLogP3.09
TPSA80.29 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds10
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.70
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-[2-[[dimethyl(1-trimethoxysilylethyl)silyl]oxy-dimethylsilyl]propyl]oxolane-2,5-dione?
The IUPAC name of 3-[2-[[dimethyl(1-trimethoxysilylethyl)silyl]oxy-dimethylsilyl]propyl]oxolane-2,5-dione (CID 89274552) is 3-[2-[[dimethyl(1-trimethoxysilylethyl)silyl]oxy-dimethylsilyl]propyl]oxolane-2,5-dione.
What is the SMILES notation for 3-[2-[[dimethyl(1-trimethoxysilylethyl)silyl]oxy-dimethylsilyl]propyl]oxolane-2,5-dione?
The canonical SMILES for 3-[2-[[dimethyl(1-trimethoxysilylethyl)silyl]oxy-dimethylsilyl]propyl]oxolane-2,5-dione is CO[Si](OC)(OC)C(C)[Si](C)(C)O[Si](C)(C)C(C)CC1CC(=O)OC1=O.
What is the InChIKey of 3-[2-[[dimethyl(1-trimethoxysilylethyl)silyl]oxy-dimethylsilyl]propyl]oxolane-2,5-dione?
The InChIKey is FOCRNVXGVBDMBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34O7Si3/c1-12(10-14-11-15(17)22-16(14)18)24(6,7)23-25(8,9)13(2)26(19-3,20-4)21-5/h12-14H,10-11H2,1-9H3.
What are the key properties of 3-[2-[[dimethyl(1-trimethoxysilylethyl)silyl]oxy-dimethylsilyl]propyl]oxolane-2,5-dione?
3-[2-[[dimethyl(1-trimethoxysilylethyl)silyl]oxy-dimethylsilyl]propyl]oxolane-2,5-dione has a molecular weight of 422.70 g/mol, XLogP of 3.09, 10 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-[[dimethyl(1-trimethoxysilylethyl)silyl]oxy-dimethylsilyl]propyl]oxolane-2,5-dione is sourced from PubChem (CID 89274552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).