methyl-bis[(2-methylpropan-2-yl)oxy]-[3-(oxiran-2-ylmethoxy)propyl]silane

C15H32O4Si — CID 139759531

IUPACmethyl-bis[(2-methylpropan-2-yl)oxy]-[3-(oxiran-2-ylmethoxy)propyl]silane
SMILESCC(C)(C)O[Si](C)(CCCOCC1CO1)OC(C)(C)C
InChIInChI=1S/C15H32O4Si/c1-14(2,3)18-20(7,19-15(4,5)6)10-8-9-16-11-13-12-17-13/h13H,8-12H2,1-7H3
InChIKeyUQSWIDYXDCJEJD-UHFFFAOYSA-N
MW304.50 g/mol
LogP3.49
Rot. Bonds8

About methyl-bis[(2-methylpropan-2-yl)oxy]-[3-(oxiran-2-ylmethoxy)propyl]silane

methyl-bis[(2-methylpropan-2-yl)oxy]-[3-(oxiran-2-ylmethoxy)propyl]silane (PubChem CID 139759531) has the molecular formula C15H32O4Si and a molecular weight of 304.50 g/mol. Its IUPAC name is methyl-bis[(2-methylpropan-2-yl)oxy]-[3-(oxiran-2-ylmethoxy)propyl]silane.

Molecular Properties

Compound Namemethyl-bis[(2-methylpropan-2-yl)oxy]-[3-(oxiran-2-ylmethoxy)propyl]silane
PubChem CID139759531
Molecular FormulaC15H32O4Si
Molecular Weight304.50 g/mol
Exact Mass304.21
IUPAC Namemethyl-bis[(2-methylpropan-2-yl)oxy]-[3-(oxiran-2-ylmethoxy)propyl]silane
SMILESCC(C)(C)O[Si](C)(CCCOCC1CO1)OC(C)(C)C
InChIInChI=1S/C15H32O4Si/c1-14(2,3)18-20(7,19-15(4,5)6)10-8-9-16-11-13-12-17-13/h13H,8-12H2,1-7H3
InChIKeyUQSWIDYXDCJEJD-UHFFFAOYSA-N
XLogP3.49
TPSA40.22 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.50
LogP ≤ 53.49
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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Frequently Asked Questions

What is the IUPAC name of methyl-bis[(2-methylpropan-2-yl)oxy]-[3-(oxiran-2-ylmethoxy)propyl]silane?
The IUPAC name of methyl-bis[(2-methylpropan-2-yl)oxy]-[3-(oxiran-2-ylmethoxy)propyl]silane (CID 139759531) is methyl-bis[(2-methylpropan-2-yl)oxy]-[3-(oxiran-2-ylmethoxy)propyl]silane.
What is the SMILES notation for methyl-bis[(2-methylpropan-2-yl)oxy]-[3-(oxiran-2-ylmethoxy)propyl]silane?
The canonical SMILES for methyl-bis[(2-methylpropan-2-yl)oxy]-[3-(oxiran-2-ylmethoxy)propyl]silane is CC(C)(C)O[Si](C)(CCCOCC1CO1)OC(C)(C)C.
What is the InChIKey of methyl-bis[(2-methylpropan-2-yl)oxy]-[3-(oxiran-2-ylmethoxy)propyl]silane?
The InChIKey is UQSWIDYXDCJEJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32O4Si/c1-14(2,3)18-20(7,19-15(4,5)6)10-8-9-16-11-13-12-17-13/h13H,8-12H2,1-7H3.
What are the key properties of methyl-bis[(2-methylpropan-2-yl)oxy]-[3-(oxiran-2-ylmethoxy)propyl]silane?
methyl-bis[(2-methylpropan-2-yl)oxy]-[3-(oxiran-2-ylmethoxy)propyl]silane has a molecular weight of 304.50 g/mol, XLogP of 3.49, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-bis[(2-methylpropan-2-yl)oxy]-[3-(oxiran-2-ylmethoxy)propyl]silane is sourced from PubChem (CID 139759531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).