dimethoxy-methyl-[2-[1-[2-(oxiran-2-yl)ethyl]cyclohexyl]ethyl]silane

C15H30O3Si — CID 174822274

IUPACdimethoxy-methyl-[2-[1-[2-(oxiran-2-yl)ethyl]cyclohexyl]ethyl]silane
SMILESCO[Si](C)(CCC1(CCC2CO2)CCCCC1)OC
InChIInChI=1S/C15H30O3Si/c1-16-19(3,17-2)12-11-15(8-5-4-6-9-15)10-7-14-13-18-14/h14H,4-13H2,1-3H3
InChIKeyJPCPEAQNMLUQJE-UHFFFAOYSA-N
MW286.49 g/mol
LogP3.87
Rot. Bonds8

About dimethoxy-methyl-[2-[1-[2-(oxiran-2-yl)ethyl]cyclohexyl]ethyl]silane

dimethoxy-methyl-[2-[1-[2-(oxiran-2-yl)ethyl]cyclohexyl]ethyl]silane (PubChem CID 174822274) has the molecular formula C15H30O3Si and a molecular weight of 286.49 g/mol. Its IUPAC name is dimethoxy-methyl-[2-[1-[2-(oxiran-2-yl)ethyl]cyclohexyl]ethyl]silane.

Molecular Properties

Compound Namedimethoxy-methyl-[2-[1-[2-(oxiran-2-yl)ethyl]cyclohexyl]ethyl]silane
PubChem CID174822274
Molecular FormulaC15H30O3Si
Molecular Weight286.49 g/mol
Exact Mass286.20
IUPAC Namedimethoxy-methyl-[2-[1-[2-(oxiran-2-yl)ethyl]cyclohexyl]ethyl]silane
SMILESCO[Si](C)(CCC1(CCC2CO2)CCCCC1)OC
InChIInChI=1S/C15H30O3Si/c1-16-19(3,17-2)12-11-15(8-5-4-6-9-15)10-7-14-13-18-14/h14H,4-13H2,1-3H3
InChIKeyJPCPEAQNMLUQJE-UHFFFAOYSA-N
XLogP3.87
TPSA30.99 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.49
LogP ≤ 53.87
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 dimethoxy-methyl-[2-[1-[2-(oxiran-2-yl)ethyl]cyclohexyl]ethyl]silane?
The IUPAC name of dimethoxy-methyl-[2-[1-[2-(oxiran-2-yl)ethyl]cyclohexyl]ethyl]silane (CID 174822274) is dimethoxy-methyl-[2-[1-[2-(oxiran-2-yl)ethyl]cyclohexyl]ethyl]silane.
What is the SMILES notation for dimethoxy-methyl-[2-[1-[2-(oxiran-2-yl)ethyl]cyclohexyl]ethyl]silane?
The canonical SMILES for dimethoxy-methyl-[2-[1-[2-(oxiran-2-yl)ethyl]cyclohexyl]ethyl]silane is CO[Si](C)(CCC1(CCC2CO2)CCCCC1)OC.
What is the InChIKey of dimethoxy-methyl-[2-[1-[2-(oxiran-2-yl)ethyl]cyclohexyl]ethyl]silane?
The InChIKey is JPCPEAQNMLUQJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30O3Si/c1-16-19(3,17-2)12-11-15(8-5-4-6-9-15)10-7-14-13-18-14/h14H,4-13H2,1-3H3.
What are the key properties of dimethoxy-methyl-[2-[1-[2-(oxiran-2-yl)ethyl]cyclohexyl]ethyl]silane?
dimethoxy-methyl-[2-[1-[2-(oxiran-2-yl)ethyl]cyclohexyl]ethyl]silane has a molecular weight of 286.49 g/mol, XLogP of 3.87, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for dimethoxy-methyl-[2-[1-[2-(oxiran-2-yl)ethyl]cyclohexyl]ethyl]silane is sourced from PubChem (CID 174822274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).