[dimethyl(7-oxabicyclo[4.1.0]heptan-3-yl)silyl]oxy-dimethyl-(7-oxabicyclo[4.1.0]heptan-3-yl)silane

C16H30O3Si2 — CID 102243382

IUPAC[dimethyl(7-oxabicyclo[4.1.0]heptan-3-yl)silyl]oxy-dimethyl-(7-oxabicyclo[4.1.0]heptan-3-yl)silane
SMILESC[Si](C)(O[Si](C)(C)C1CCC2OC2C1)C1CCC2OC2C1
InChIInChI=1S/C16H30O3Si2/c1-20(2,11-5-7-13-15(9-11)17-13)19-21(3,4)12-6-8-14-16(10-12)18-14/h11-16H,5-10H2,1-4H3
InChIKeyAERMRWXPNPGXNR-UHFFFAOYSA-N
MW326.59 g/mol
LogP4.06
Rot. Bonds4

About [dimethyl(7-oxabicyclo[4.1.0]heptan-3-yl)silyl]oxy-dimethyl-(7-oxabicyclo[4.1.0]heptan-3-yl)silane

[dimethyl(7-oxabicyclo[4.1.0]heptan-3-yl)silyl]oxy-dimethyl-(7-oxabicyclo[4.1.0]heptan-3-yl)silane (PubChem CID 102243382) has the molecular formula C16H30O3Si2 and a molecular weight of 326.59 g/mol. Its IUPAC name is [dimethyl(7-oxabicyclo[4.1.0]heptan-3-yl)silyl]oxy-dimethyl-(7-oxabicyclo[4.1.0]heptan-3-yl)silane.

Molecular Properties

Compound Name[dimethyl(7-oxabicyclo[4.1.0]heptan-3-yl)silyl]oxy-dimethyl-(7-oxabicyclo[4.1.0]heptan-3-yl)silane
PubChem CID102243382
Molecular FormulaC16H30O3Si2
Molecular Weight326.59 g/mol
Exact Mass326.17
IUPAC Name[dimethyl(7-oxabicyclo[4.1.0]heptan-3-yl)silyl]oxy-dimethyl-(7-oxabicyclo[4.1.0]heptan-3-yl)silane
SMILESC[Si](C)(O[Si](C)(C)C1CCC2OC2C1)C1CCC2OC2C1
InChIInChI=1S/C16H30O3Si2/c1-20(2,11-5-7-13-15(9-11)17-13)19-21(3,4)12-6-8-14-16(10-12)18-14/h11-16H,5-10H2,1-4H3
InChIKeyAERMRWXPNPGXNR-UHFFFAOYSA-N
XLogP4.06
TPSA34.29 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.59
LogP ≤ 54.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(1S,4S)-5-oxabicyclo[2.1.0]pentane
CID 98125749
[dimethyl-[2-[(1R,3R,6R)-7-oxabicyclo[4.1.0]heptan-3-yl]ethyl]silyl]oxy-dimethyl-[2-[(1R,3S,6S)-7-oxabicyclo[4.1.0]heptan-3-yl]ethyl]silane
CID 99774414
[dimethyl-[2-[(1R,3R,6R)-7-oxabicyclo[4.1.0]heptan-3-yl]ethyl]silyl]oxy-dimethyl-[2-[(1R,3S,6R)-7-oxabicyclo[4.1.0]heptan-3-yl]ethyl]silane
CID 99774411
[dimethyl-[2-(7-oxabicyclo[4.1.0]heptan-3-yl)ethyl]silyl]oxy-[[dimethyl-[2-(7-oxabicyclo[4.1.0]heptan-3-yl)ethyl]silyl]oxy-[dimethyl(7-oxabicyclo[4.1.0]heptan-3-yl)silyl]oxy-phenylsilyl]oxy-phenyl-trimethylsilyloxysilane
CID 59846975
3-cyclopropyl-7-oxabicyclo[4.1.0]heptane
CID 88535344
bis[[[dimethyl-[2-(7-oxabicyclo[4.1.0]heptan-3-yl)ethyl]silyl]oxy-dimethylsilyl]oxy]-dimethylsilane
CID 102070616
4-methyl-8-oxabicyclo[5.1.0]octane
CID 45120447
(1R,6R)-7-oxabicyclo[4.1.0]heptan-3-ol
CID 12636256
bis[[dimethoxy-[2-(7-oxabicyclo[4.1.0]heptan-3-yl)ethyl]silyl]oxy]-dimethylsilane
CID 59882614
[dimethyl-[2-(7-oxabicyclo[4.1.0]heptan-3-yl)ethyl]silyl]oxy-[2-[[dimethyl-[2-(7-oxabicyclo[4.1.0]heptan-3-yl)ethyl]silyl]oxy-dihydroxysilyl]ethyl]-dihydroxysilane
CID 140841095
dimethoxy-methyl-[tris(7-oxabicyclo[4.1.0]heptan-3-yl)methoxy]silane
CID 162215767
3-(3-methyloxiran-2-yl)-7-oxabicyclo[4.1.0]heptane
CID 19973707

Frequently Asked Questions

What is the IUPAC name of [dimethyl(7-oxabicyclo[4.1.0]heptan-3-yl)silyl]oxy-dimethyl-(7-oxabicyclo[4.1.0]heptan-3-yl)silane?
The IUPAC name of [dimethyl(7-oxabicyclo[4.1.0]heptan-3-yl)silyl]oxy-dimethyl-(7-oxabicyclo[4.1.0]heptan-3-yl)silane (CID 102243382) is [dimethyl(7-oxabicyclo[4.1.0]heptan-3-yl)silyl]oxy-dimethyl-(7-oxabicyclo[4.1.0]heptan-3-yl)silane.
What is the SMILES notation for [dimethyl(7-oxabicyclo[4.1.0]heptan-3-yl)silyl]oxy-dimethyl-(7-oxabicyclo[4.1.0]heptan-3-yl)silane?
The canonical SMILES for [dimethyl(7-oxabicyclo[4.1.0]heptan-3-yl)silyl]oxy-dimethyl-(7-oxabicyclo[4.1.0]heptan-3-yl)silane is C[Si](C)(O[Si](C)(C)C1CCC2OC2C1)C1CCC2OC2C1.
What is the InChIKey of [dimethyl(7-oxabicyclo[4.1.0]heptan-3-yl)silyl]oxy-dimethyl-(7-oxabicyclo[4.1.0]heptan-3-yl)silane?
The InChIKey is AERMRWXPNPGXNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30O3Si2/c1-20(2,11-5-7-13-15(9-11)17-13)19-21(3,4)12-6-8-14-16(10-12)18-14/h11-16H,5-10H2,1-4H3.
What are the key properties of [dimethyl(7-oxabicyclo[4.1.0]heptan-3-yl)silyl]oxy-dimethyl-(7-oxabicyclo[4.1.0]heptan-3-yl)silane?
[dimethyl(7-oxabicyclo[4.1.0]heptan-3-yl)silyl]oxy-dimethyl-(7-oxabicyclo[4.1.0]heptan-3-yl)silane has a molecular weight of 326.59 g/mol, XLogP of 4.06, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [dimethyl(7-oxabicyclo[4.1.0]heptan-3-yl)silyl]oxy-dimethyl-(7-oxabicyclo[4.1.0]heptan-3-yl)silane is sourced from PubChem (CID 102243382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).