dibutoxy-ethyl-[2-(oxiran-2-ylmethoxy)ethyl]silane

C15H32O4Si — CID 21432023

IUPACdibutoxy-ethyl-[2-(oxiran-2-ylmethoxy)ethyl]silane
SMILESCCCCO[Si](CC)(CCOCC1CO1)OCCCC
InChIInChI=1S/C15H32O4Si/c1-4-7-9-18-20(6-3,19-10-8-5-2)12-11-16-13-15-14-17-15/h15H,4-14H2,1-3H3
InChIKeyJUFOKMUSGQGJPL-UHFFFAOYSA-N
MW304.50 g/mol
LogP3.50
Rot. Bonds14

About dibutoxy-ethyl-[2-(oxiran-2-ylmethoxy)ethyl]silane

dibutoxy-ethyl-[2-(oxiran-2-ylmethoxy)ethyl]silane (PubChem CID 21432023) has the molecular formula C15H32O4Si and a molecular weight of 304.50 g/mol. Its IUPAC name is dibutoxy-ethyl-[2-(oxiran-2-ylmethoxy)ethyl]silane.

Molecular Properties

Compound Namedibutoxy-ethyl-[2-(oxiran-2-ylmethoxy)ethyl]silane
PubChem CID21432023
Molecular FormulaC15H32O4Si
Molecular Weight304.50 g/mol
Exact Mass304.21
IUPAC Namedibutoxy-ethyl-[2-(oxiran-2-ylmethoxy)ethyl]silane
SMILESCCCCO[Si](CC)(CCOCC1CO1)OCCCC
InChIInChI=1S/C15H32O4Si/c1-4-7-9-18-20(6-3,19-10-8-5-2)12-11-16-13-15-14-17-15/h15H,4-14H2,1-3H3
InChIKeyJUFOKMUSGQGJPL-UHFFFAOYSA-N
XLogP3.50
TPSA40.22 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds14
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.50
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

diethoxy-ethyl-[2-(oxiran-2-ylmethoxy)ethyl]silane
CID 21432048
CID 166063430
CID 166063430
2-(pentoxymethyl)oxirane
CID 160890113
dibutoxy-methyl-(oxiran-2-ylmethoxymethyl)silane
CID 54372055
dimethyl-octyl-[3-(oxiran-2-ylmethoxy)propyl]silane
CID 163299953
(2S)-2-(octoxymethyl)oxirane
CID 87274801
2-(hexoxymethyl)oxirane;2-(pentoxymethyl)oxirane
CID 159895637
2-(tricosoxymethyl)oxirane
CID 57227005
2-(octoxymethyl)oxirane;2-(tetradecoxymethyl)oxirane
CID 174518537
2-(decoxymethyl)oxirane;2-(nonoxymethyl)oxirane;2-(octoxymethyl)oxirane
CID 71311396
diethyl-methyl-[3-(oxiran-2-ylmethoxy)propyl]silane
CID 139945217
2-(propoxymethyl)oxirane
CID 18406

Frequently Asked Questions

What is the IUPAC name of dibutoxy-ethyl-[2-(oxiran-2-ylmethoxy)ethyl]silane?
The IUPAC name of dibutoxy-ethyl-[2-(oxiran-2-ylmethoxy)ethyl]silane (CID 21432023) is dibutoxy-ethyl-[2-(oxiran-2-ylmethoxy)ethyl]silane.
What is the SMILES notation for dibutoxy-ethyl-[2-(oxiran-2-ylmethoxy)ethyl]silane?
The canonical SMILES for dibutoxy-ethyl-[2-(oxiran-2-ylmethoxy)ethyl]silane is CCCCO[Si](CC)(CCOCC1CO1)OCCCC.
What is the InChIKey of dibutoxy-ethyl-[2-(oxiran-2-ylmethoxy)ethyl]silane?
The InChIKey is JUFOKMUSGQGJPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32O4Si/c1-4-7-9-18-20(6-3,19-10-8-5-2)12-11-16-13-15-14-17-15/h15H,4-14H2,1-3H3.
What are the key properties of dibutoxy-ethyl-[2-(oxiran-2-ylmethoxy)ethyl]silane?
dibutoxy-ethyl-[2-(oxiran-2-ylmethoxy)ethyl]silane has a molecular weight of 304.50 g/mol, XLogP of 3.50, 14 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for dibutoxy-ethyl-[2-(oxiran-2-ylmethoxy)ethyl]silane is sourced from PubChem (CID 21432023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).