2,2,5-trimethyl-1,4,2-dioxasilepane

C7H16O2Si — CID 68812586

IUPAC2,2,5-trimethyl-1,4,2-dioxasilepane
SMILESCC1CCO[Si](C)(C)CO1
InChIInChI=1S/C7H16O2Si/c1-7-4-5-9-10(2,3)6-8-7/h7H,4-6H2,1-3H3
InChIKeyIPYWFLWULMDARQ-UHFFFAOYSA-N
MW160.29 g/mol
LogP1.56
Rot. Bonds

About 2,2,5-trimethyl-1,4,2-dioxasilepane

2,2,5-trimethyl-1,4,2-dioxasilepane (PubChem CID 68812586) has the molecular formula C7H16O2Si and a molecular weight of 160.29 g/mol. Its IUPAC name is 2,2,5-trimethyl-1,4,2-dioxasilepane.

Molecular Properties

Compound Name2,2,5-trimethyl-1,4,2-dioxasilepane
PubChem CID68812586
Molecular FormulaC7H16O2Si
Molecular Weight160.29 g/mol
Exact Mass160.09
IUPAC Name2,2,5-trimethyl-1,4,2-dioxasilepane
SMILESCC1CCO[Si](C)(C)CO1
InChIInChI=1S/C7H16O2Si/c1-7-4-5-9-10(2,3)6-8-7/h7H,4-6H2,1-3H3
InChIKeyIPYWFLWULMDARQ-UHFFFAOYSA-N
XLogP1.56
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.29
LogP ≤ 51.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-methyloxane;hydrochloride
CID 141105834
2-methyloxane;propane
CID 171074580
2,2,3-trimethyloxasilepane
CID 22966650
2-methyloxolane;oxolane
CID 69253648
2,2-dimethyloxasilolane;2,2,3-trimethyloxasilolane
CID 19097651
4-methyl-1,3-dioxonane
CID 68561619
ethane;4-methyl-1,3-dioxane
CID 91314442
2-methoxy-2-methylpropane;2-methyloxolane
CID 67153137
ethane;formaldehyde;2-methyloxolane
CID 145378358
2-methyloxane sulfamate
CID 22223465
2,2,6,6-tetramethyl-1,5,2,6-dioxadisilocane
CID 12619896
5-methyl-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one
CID 83244374

Frequently Asked Questions

What is the IUPAC name of 2,2,5-trimethyl-1,4,2-dioxasilepane?
The IUPAC name of 2,2,5-trimethyl-1,4,2-dioxasilepane (CID 68812586) is 2,2,5-trimethyl-1,4,2-dioxasilepane.
What is the SMILES notation for 2,2,5-trimethyl-1,4,2-dioxasilepane?
The canonical SMILES for 2,2,5-trimethyl-1,4,2-dioxasilepane is CC1CCO[Si](C)(C)CO1.
What is the InChIKey of 2,2,5-trimethyl-1,4,2-dioxasilepane?
The InChIKey is IPYWFLWULMDARQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16O2Si/c1-7-4-5-9-10(2,3)6-8-7/h7H,4-6H2,1-3H3.
What are the key properties of 2,2,5-trimethyl-1,4,2-dioxasilepane?
2,2,5-trimethyl-1,4,2-dioxasilepane has a molecular weight of 160.29 g/mol, XLogP of 1.56, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,5-trimethyl-1,4,2-dioxasilepane is sourced from PubChem (CID 68812586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).