oxepan-2-one;silyloxysilane

C6H16O3Si2 — CID 173274127

IUPACoxepan-2-one;silyloxysilane
SMILESO=C1CCCCCO1.[SiH3]O[SiH3]
InChIInChI=1S/C6H10O2.H6OSi2/c7-6-4-2-1-3-5-8-6;2-1-3/h1-5H2;2-3H3
InChIKeyRHAXDILAGMQZJQ-UHFFFAOYSA-N
MW192.36 g/mol
LogP-1.33
Rot. Bonds

About oxepan-2-one;silyloxysilane

oxepan-2-one;silyloxysilane (PubChem CID 173274127) has the molecular formula C6H16O3Si2 and a molecular weight of 192.36 g/mol. Its IUPAC name is oxepan-2-one;silyloxysilane.

Molecular Properties

Compound Nameoxepan-2-one;silyloxysilane
PubChem CID173274127
Molecular FormulaC6H16O3Si2
Molecular Weight192.36 g/mol
Exact Mass192.06
IUPAC Nameoxepan-2-one;silyloxysilane
SMILESO=C1CCCCCO1.[SiH3]O[SiH3]
InChIInChI=1S/C6H10O2.H6OSi2/c7-6-4-2-1-3-5-8-6;2-1-3/h1-5H2;2-3H3
InChIKeyRHAXDILAGMQZJQ-UHFFFAOYSA-N
XLogP-1.33
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.36
LogP ≤ 5-1.33
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 oxepan-2-one;silyloxysilane?
The IUPAC name of oxepan-2-one;silyloxysilane (CID 173274127) is oxepan-2-one;silyloxysilane.
What is the SMILES notation for oxepan-2-one;silyloxysilane?
The canonical SMILES for oxepan-2-one;silyloxysilane is O=C1CCCCCO1.[SiH3]O[SiH3].
What is the InChIKey of oxepan-2-one;silyloxysilane?
The InChIKey is RHAXDILAGMQZJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10O2.H6OSi2/c7-6-4-2-1-3-5-8-6;2-1-3/h1-5H2;2-3H3.
What are the key properties of oxepan-2-one;silyloxysilane?
oxepan-2-one;silyloxysilane has a molecular weight of 192.36 g/mol, XLogP of -1.33, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for oxepan-2-one;silyloxysilane is sourced from PubChem (CID 173274127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).