[2-[silyl-bis(2-silyloxan-2-yl)methyl]oxan-2-yl]silane

C16H36O3Si4 — CID 123765800

IUPAC[2-[silyl-bis(2-silyloxan-2-yl)methyl]oxan-2-yl]silane
SMILES[SiH3]C1(C([SiH3])(C2([SiH3])CCCCO2)C2([SiH3])CCCCO2)CCCCO1
InChIInChI=1S/C16H36O3Si4/c20-13(7-1-4-10-17-13)16(23,14(21)8-2-5-11-18-14)15(22)9-3-6-12-19-15/h1-12H2,20-23H3
InChIKeyMNBQZLJNJVIHHD-UHFFFAOYSA-N
MW388.81 g/mol
LogP-1.70
Rot. Bonds3

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

[2-[silyl-bis(2-silyloxan-2-yl)methyl]oxan-2-yl]silane (PubChem CID 123765800) has the molecular formula C16H36O3Si4 and a molecular weight of 388.81 g/mol. Its IUPAC name is [2-[silyl-bis(2-silyloxan-2-yl)methyl]oxan-2-yl]silane.

Molecular Properties

Compound Name[2-[silyl-bis(2-silyloxan-2-yl)methyl]oxan-2-yl]silane
PubChem CID123765800
Molecular FormulaC16H36O3Si4
Molecular Weight388.81 g/mol
Exact Mass388.17
IUPAC Name[2-[silyl-bis(2-silyloxan-2-yl)methyl]oxan-2-yl]silane
SMILES[SiH3]C1(C([SiH3])(C2([SiH3])CCCCO2)C2([SiH3])CCCCO2)CCCCO1
InChIInChI=1S/C16H36O3Si4/c20-13(7-1-4-10-17-13)16(23,14(21)8-2-5-11-18-14)15(22)9-3-6-12-19-15/h1-12H2,20-23H3
InChIKeyMNBQZLJNJVIHHD-UHFFFAOYSA-N
XLogP-1.70
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.81
LogP ≤ 5-1.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [2-[silyl-bis(2-silyloxan-2-yl)methyl]oxan-2-yl]silane?
The IUPAC name of [2-[silyl-bis(2-silyloxan-2-yl)methyl]oxan-2-yl]silane (CID 123765800) is [2-[silyl-bis(2-silyloxan-2-yl)methyl]oxan-2-yl]silane.
What is the SMILES notation for [2-[silyl-bis(2-silyloxan-2-yl)methyl]oxan-2-yl]silane?
The canonical SMILES for [2-[silyl-bis(2-silyloxan-2-yl)methyl]oxan-2-yl]silane is [SiH3]C1(C([SiH3])(C2([SiH3])CCCCO2)C2([SiH3])CCCCO2)CCCCO1.
What is the InChIKey of [2-[silyl-bis(2-silyloxan-2-yl)methyl]oxan-2-yl]silane?
The InChIKey is MNBQZLJNJVIHHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H36O3Si4/c20-13(7-1-4-10-17-13)16(23,14(21)8-2-5-11-18-14)15(22)9-3-6-12-19-15/h1-12H2,20-23H3.
What are the key properties of [2-[silyl-bis(2-silyloxan-2-yl)methyl]oxan-2-yl]silane?
[2-[silyl-bis(2-silyloxan-2-yl)methyl]oxan-2-yl]silane has a molecular weight of 388.81 g/mol, XLogP of -1.70, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[silyl-bis(2-silyloxan-2-yl)methyl]oxan-2-yl]silane is sourced from PubChem (CID 123765800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).