trimethyl-[1-(oxiran-2-yl)-1-[1-(oxiran-2-yl)-1-trimethylsilylbutoxy]butyl]silane

C18H38O3Si2 — CID 154155440

IUPACtrimethyl-[1-(oxiran-2-yl)-1-[1-(oxiran-2-yl)-1-trimethylsilylbutoxy]butyl]silane
SMILESCCCC(OC(CCC)(C1CO1)[Si](C)(C)C)(C1CO1)[Si](C)(C)C
InChIInChI=1S/C18H38O3Si2/c1-9-11-17(15-13-19-15,22(3,4)5)21-18(12-10-2,16-14-20-16)23(6,7)8/h15-16H,9-14H2,1-8H3
InChIKeyVQMGKISPBHGCFG-UHFFFAOYSA-N
MW358.67 g/mol
LogP4.63
Rot. Bonds10

About trimethyl-[1-(oxiran-2-yl)-1-[1-(oxiran-2-yl)-1-trimethylsilylbutoxy]butyl]silane

trimethyl-[1-(oxiran-2-yl)-1-[1-(oxiran-2-yl)-1-trimethylsilylbutoxy]butyl]silane (PubChem CID 154155440) has the molecular formula C18H38O3Si2 and a molecular weight of 358.67 g/mol. Its IUPAC name is trimethyl-[1-(oxiran-2-yl)-1-[1-(oxiran-2-yl)-1-trimethylsilylbutoxy]butyl]silane.

Molecular Properties

Compound Nametrimethyl-[1-(oxiran-2-yl)-1-[1-(oxiran-2-yl)-1-trimethylsilylbutoxy]butyl]silane
PubChem CID154155440
Molecular FormulaC18H38O3Si2
Molecular Weight358.67 g/mol
Exact Mass358.24
IUPAC Nametrimethyl-[1-(oxiran-2-yl)-1-[1-(oxiran-2-yl)-1-trimethylsilylbutoxy]butyl]silane
SMILESCCCC(OC(CCC)(C1CO1)[Si](C)(C)C)(C1CO1)[Si](C)(C)C
InChIInChI=1S/C18H38O3Si2/c1-9-11-17(15-13-19-15,22(3,4)5)21-18(12-10-2,16-14-20-16)23(6,7)8/h15-16H,9-14H2,1-8H3
InChIKeyVQMGKISPBHGCFG-UHFFFAOYSA-N
XLogP4.63
TPSA34.29 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.67
LogP ≤ 54.63
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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Frequently Asked Questions

What is the IUPAC name of trimethyl-[1-(oxiran-2-yl)-1-[1-(oxiran-2-yl)-1-trimethylsilylbutoxy]butyl]silane?
The IUPAC name of trimethyl-[1-(oxiran-2-yl)-1-[1-(oxiran-2-yl)-1-trimethylsilylbutoxy]butyl]silane (CID 154155440) is trimethyl-[1-(oxiran-2-yl)-1-[1-(oxiran-2-yl)-1-trimethylsilylbutoxy]butyl]silane.
What is the SMILES notation for trimethyl-[1-(oxiran-2-yl)-1-[1-(oxiran-2-yl)-1-trimethylsilylbutoxy]butyl]silane?
The canonical SMILES for trimethyl-[1-(oxiran-2-yl)-1-[1-(oxiran-2-yl)-1-trimethylsilylbutoxy]butyl]silane is CCCC(OC(CCC)(C1CO1)[Si](C)(C)C)(C1CO1)[Si](C)(C)C.
What is the InChIKey of trimethyl-[1-(oxiran-2-yl)-1-[1-(oxiran-2-yl)-1-trimethylsilylbutoxy]butyl]silane?
The InChIKey is VQMGKISPBHGCFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H38O3Si2/c1-9-11-17(15-13-19-15,22(3,4)5)21-18(12-10-2,16-14-20-16)23(6,7)8/h15-16H,9-14H2,1-8H3.
What are the key properties of trimethyl-[1-(oxiran-2-yl)-1-[1-(oxiran-2-yl)-1-trimethylsilylbutoxy]butyl]silane?
trimethyl-[1-(oxiran-2-yl)-1-[1-(oxiran-2-yl)-1-trimethylsilylbutoxy]butyl]silane has a molecular weight of 358.67 g/mol, XLogP of 4.63, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[1-(oxiran-2-yl)-1-[1-(oxiran-2-yl)-1-trimethylsilylbutoxy]butyl]silane is sourced from PubChem (CID 154155440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).