2-[3-[2-[diethoxy(methyl)silyl]ethyl]oxiran-2-yl]ethyl-diethoxy-methylsilane

C16H36O5Si2 — CID 139997357

IUPAC2-[3-[2-[diethoxy(methyl)silyl]ethyl]oxiran-2-yl]ethyl-diethoxy-methylsilane
SMILESCCO[Si](C)(CCC1OC1CC[Si](C)(OCC)OCC)OCC
InChIInChI=1S/C16H36O5Si2/c1-7-17-22(5,18-8-2)13-11-15-16(21-15)12-14-23(6,19-9-3)20-10-4/h15-16H,7-14H2,1-6H3
InChIKeyQGTCGJBTXKRZCB-UHFFFAOYSA-N
MW364.63 g/mol
LogP3.82
Rot. Bonds14

About 2-[3-[2-[diethoxy(methyl)silyl]ethyl]oxiran-2-yl]ethyl-diethoxy-methylsilane

2-[3-[2-[diethoxy(methyl)silyl]ethyl]oxiran-2-yl]ethyl-diethoxy-methylsilane (PubChem CID 139997357) has the molecular formula C16H36O5Si2 and a molecular weight of 364.63 g/mol. Its IUPAC name is 2-[3-[2-[diethoxy(methyl)silyl]ethyl]oxiran-2-yl]ethyl-diethoxy-methylsilane.

Molecular Properties

Compound Name2-[3-[2-[diethoxy(methyl)silyl]ethyl]oxiran-2-yl]ethyl-diethoxy-methylsilane
PubChem CID139997357
Molecular FormulaC16H36O5Si2
Molecular Weight364.63 g/mol
Exact Mass364.21
IUPAC Name2-[3-[2-[diethoxy(methyl)silyl]ethyl]oxiran-2-yl]ethyl-diethoxy-methylsilane
SMILESCCO[Si](C)(CCC1OC1CC[Si](C)(OCC)OCC)OCC
InChIInChI=1S/C16H36O5Si2/c1-7-17-22(5,18-8-2)13-11-15-16(21-15)12-14-23(6,19-9-3)20-10-4/h15-16H,7-14H2,1-6H3
InChIKeyQGTCGJBTXKRZCB-UHFFFAOYSA-N
XLogP3.82
TPSA49.45 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds14
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.63
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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

[diethoxy(methyl)silyl]methyl-diethoxy-methylsilane
CID 13131406
diethoxy-methyl-(2-piperidin-2-ylethyl)silane
CID 68839529
diethoxy-methyl-undecylsilane
CID 140884401
triethoxy(methyl)silane
CID 16241
N-[3-[diethoxy(methyl)silyl]propyl]butan-1-amine
CID 22679052
diethoxy-methyl-(2-trimethylsilylsulfanylethyl)silane
CID 88867782
[diethoxy(methyl)silyl]methanethiol;3-[diethoxy(methyl)silyl]propyl-diethoxy-methylsilane
CID 165005930
triethoxy(methyl)silane;hydrate
CID 159569985
diethoxy-[3-(ethoxy-ethyl-methylsilyl)propyl]-methylsilane
CID 58151778
N-[[diethoxy(methyl)silyl]methyl]cyclohexanamine
CID 18468764
1-[diethoxy(methyl)silyl]-N-methylhexan-3-amine
CID 175202132
N-[3-[diethoxy(methyl)silyl]propyl]formamide
CID 125472982

Frequently Asked Questions

What is the IUPAC name of 2-[3-[2-[diethoxy(methyl)silyl]ethyl]oxiran-2-yl]ethyl-diethoxy-methylsilane?
The IUPAC name of 2-[3-[2-[diethoxy(methyl)silyl]ethyl]oxiran-2-yl]ethyl-diethoxy-methylsilane (CID 139997357) is 2-[3-[2-[diethoxy(methyl)silyl]ethyl]oxiran-2-yl]ethyl-diethoxy-methylsilane.
What is the SMILES notation for 2-[3-[2-[diethoxy(methyl)silyl]ethyl]oxiran-2-yl]ethyl-diethoxy-methylsilane?
The canonical SMILES for 2-[3-[2-[diethoxy(methyl)silyl]ethyl]oxiran-2-yl]ethyl-diethoxy-methylsilane is CCO[Si](C)(CCC1OC1CC[Si](C)(OCC)OCC)OCC.
What is the InChIKey of 2-[3-[2-[diethoxy(methyl)silyl]ethyl]oxiran-2-yl]ethyl-diethoxy-methylsilane?
The InChIKey is QGTCGJBTXKRZCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H36O5Si2/c1-7-17-22(5,18-8-2)13-11-15-16(21-15)12-14-23(6,19-9-3)20-10-4/h15-16H,7-14H2,1-6H3.
What are the key properties of 2-[3-[2-[diethoxy(methyl)silyl]ethyl]oxiran-2-yl]ethyl-diethoxy-methylsilane?
2-[3-[2-[diethoxy(methyl)silyl]ethyl]oxiran-2-yl]ethyl-diethoxy-methylsilane has a molecular weight of 364.63 g/mol, XLogP of 3.82, 14 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[2-[diethoxy(methyl)silyl]ethyl]oxiran-2-yl]ethyl-diethoxy-methylsilane is sourced from PubChem (CID 139997357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).