dimethyl-[2-[[2-[methyl(tetradecyl)silyl]oxan-2-yl]methyl]oxan-2-yl]silane

C28H58O2Si2 — CID 173403325

IUPACdimethyl-[2-[[2-[methyl(tetradecyl)silyl]oxan-2-yl]methyl]oxan-2-yl]silane
SMILESCCCCCCCCCCCCCC[SiH](C)C1(CC2([SiH](C)C)CCCCO2)CCCCO1
InChIInChI=1S/C28H58O2Si2/c1-5-6-7-8-9-10-11-12-13-14-15-20-25-32(4)28(22-17-19-24-30-28)26-27(31(2)3)21-16-18-23-29-27/h31-32H,5-26H2,1-4H3
InChIKeyZCCFHAHJXKFZKY-UHFFFAOYSA-N
MW482.94 g/mol
LogP8.38
Rot. Bonds17

About dimethyl-[2-[[2-[methyl(tetradecyl)silyl]oxan-2-yl]methyl]oxan-2-yl]silane

dimethyl-[2-[[2-[methyl(tetradecyl)silyl]oxan-2-yl]methyl]oxan-2-yl]silane (PubChem CID 173403325) has the molecular formula C28H58O2Si2 and a molecular weight of 482.94 g/mol. Its IUPAC name is dimethyl-[2-[[2-[methyl(tetradecyl)silyl]oxan-2-yl]methyl]oxan-2-yl]silane.

Molecular Properties

Compound Namedimethyl-[2-[[2-[methyl(tetradecyl)silyl]oxan-2-yl]methyl]oxan-2-yl]silane
PubChem CID173403325
Molecular FormulaC28H58O2Si2
Molecular Weight482.94 g/mol
Exact Mass482.40
IUPAC Namedimethyl-[2-[[2-[methyl(tetradecyl)silyl]oxan-2-yl]methyl]oxan-2-yl]silane
SMILESCCCCCCCCCCCCCC[SiH](C)C1(CC2([SiH](C)C)CCCCO2)CCCCO1
InChIInChI=1S/C28H58O2Si2/c1-5-6-7-8-9-10-11-12-13-14-15-20-25-32(4)28(22-17-19-24-30-28)26-27(31(2)3)21-16-18-23-29-27/h31-32H,5-26H2,1-4H3
InChIKeyZCCFHAHJXKFZKY-UHFFFAOYSA-N
XLogP8.38
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds17
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500482.94
LogP ≤ 58.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of dimethyl-[2-[[2-[methyl(tetradecyl)silyl]oxan-2-yl]methyl]oxan-2-yl]silane?
The IUPAC name of dimethyl-[2-[[2-[methyl(tetradecyl)silyl]oxan-2-yl]methyl]oxan-2-yl]silane (CID 173403325) is dimethyl-[2-[[2-[methyl(tetradecyl)silyl]oxan-2-yl]methyl]oxan-2-yl]silane.
What is the SMILES notation for dimethyl-[2-[[2-[methyl(tetradecyl)silyl]oxan-2-yl]methyl]oxan-2-yl]silane?
The canonical SMILES for dimethyl-[2-[[2-[methyl(tetradecyl)silyl]oxan-2-yl]methyl]oxan-2-yl]silane is CCCCCCCCCCCCCC[SiH](C)C1(CC2([SiH](C)C)CCCCO2)CCCCO1.
What is the InChIKey of dimethyl-[2-[[2-[methyl(tetradecyl)silyl]oxan-2-yl]methyl]oxan-2-yl]silane?
The InChIKey is ZCCFHAHJXKFZKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H58O2Si2/c1-5-6-7-8-9-10-11-12-13-14-15-20-25-32(4)28(22-17-19-24-30-28)26-27(31(2)3)21-16-18-23-29-27/h31-32H,5-26H2,1-4H3.
What are the key properties of dimethyl-[2-[[2-[methyl(tetradecyl)silyl]oxan-2-yl]methyl]oxan-2-yl]silane?
dimethyl-[2-[[2-[methyl(tetradecyl)silyl]oxan-2-yl]methyl]oxan-2-yl]silane has a molecular weight of 482.94 g/mol, XLogP of 8.38, 17 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-[2-[[2-[methyl(tetradecyl)silyl]oxan-2-yl]methyl]oxan-2-yl]silane is sourced from PubChem (CID 173403325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).