methyl-octyl-[2-[(2-silyloxan-2-yl)methyl]oxan-2-yl]silane

C20H42O2Si2 — CID 173021808

IUPACmethyl-octyl-[2-[(2-silyloxan-2-yl)methyl]oxan-2-yl]silane
SMILESCCCCCCCC[SiH](C)C1(CC2([SiH3])CCCCO2)CCCCO1
InChIInChI=1S/C20H42O2Si2/c1-3-4-5-6-7-12-17-24(2)20(14-9-11-16-22-20)18-19(23)13-8-10-15-21-19/h24H,3-18H2,1-2,23H3
InChIKeyKBMCIYXHJCMRMM-UHFFFAOYSA-N
MW370.73 g/mol
LogP4.33
Rot. Bonds10

About methyl-octyl-[2-[(2-silyloxan-2-yl)methyl]oxan-2-yl]silane

methyl-octyl-[2-[(2-silyloxan-2-yl)methyl]oxan-2-yl]silane (PubChem CID 173021808) has the molecular formula C20H42O2Si2 and a molecular weight of 370.73 g/mol. Its IUPAC name is methyl-octyl-[2-[(2-silyloxan-2-yl)methyl]oxan-2-yl]silane.

Molecular Properties

Compound Namemethyl-octyl-[2-[(2-silyloxan-2-yl)methyl]oxan-2-yl]silane
PubChem CID173021808
Molecular FormulaC20H42O2Si2
Molecular Weight370.73 g/mol
Exact Mass370.27
IUPAC Namemethyl-octyl-[2-[(2-silyloxan-2-yl)methyl]oxan-2-yl]silane
SMILESCCCCCCCC[SiH](C)C1(CC2([SiH3])CCCCO2)CCCCO1
InChIInChI=1S/C20H42O2Si2/c1-3-4-5-6-7-12-17-24(2)20(14-9-11-16-22-20)18-19(23)13-8-10-15-21-19/h24H,3-18H2,1-2,23H3
InChIKeyKBMCIYXHJCMRMM-UHFFFAOYSA-N
XLogP4.33
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.73
LogP ≤ 54.33
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 methyl-octyl-[2-[(2-silyloxan-2-yl)methyl]oxan-2-yl]silane?
The IUPAC name of methyl-octyl-[2-[(2-silyloxan-2-yl)methyl]oxan-2-yl]silane (CID 173021808) is methyl-octyl-[2-[(2-silyloxan-2-yl)methyl]oxan-2-yl]silane.
What is the SMILES notation for methyl-octyl-[2-[(2-silyloxan-2-yl)methyl]oxan-2-yl]silane?
The canonical SMILES for methyl-octyl-[2-[(2-silyloxan-2-yl)methyl]oxan-2-yl]silane is CCCCCCCC[SiH](C)C1(CC2([SiH3])CCCCO2)CCCCO1.
What is the InChIKey of methyl-octyl-[2-[(2-silyloxan-2-yl)methyl]oxan-2-yl]silane?
The InChIKey is KBMCIYXHJCMRMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H42O2Si2/c1-3-4-5-6-7-12-17-24(2)20(14-9-11-16-22-20)18-19(23)13-8-10-15-21-19/h24H,3-18H2,1-2,23H3.
What are the key properties of methyl-octyl-[2-[(2-silyloxan-2-yl)methyl]oxan-2-yl]silane?
methyl-octyl-[2-[(2-silyloxan-2-yl)methyl]oxan-2-yl]silane has a molecular weight of 370.73 g/mol, XLogP of 4.33, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-octyl-[2-[(2-silyloxan-2-yl)methyl]oxan-2-yl]silane is sourced from PubChem (CID 173021808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).