trimethyl-[[(1R,5S)-8-oxabicyclo[3.2.1]oct-2-en-3-yl]oxy]silane

C10H18O2Si — CID 10081462

IUPACtrimethyl-[[(1R,5S)-8-oxabicyclo[3.2.1]oct-2-en-3-yl]oxy]silane
SMILESC[Si](C)(C)OC1=C[C@H]2CC[C@@H](C1)O2
InChIInChI=1S/C10H18O2Si/c1-13(2,3)12-10-6-8-4-5-9(7-10)11-8/h6,8-9H,4-5,7H2,1-3H3/t8-,9+/m1/s1
InChIKeyLDDSYOHYZHNABX-BDAKNGLRSA-N
MW198.34 g/mol
LogP2.67
Rot. Bonds2

About trimethyl-[[(1R,5S)-8-oxabicyclo[3.2.1]oct-2-en-3-yl]oxy]silane

trimethyl-[[(1R,5S)-8-oxabicyclo[3.2.1]oct-2-en-3-yl]oxy]silane (PubChem CID 10081462) has the molecular formula C10H18O2Si and a molecular weight of 198.34 g/mol. Its IUPAC name is trimethyl-[[(1R,5S)-8-oxabicyclo[3.2.1]oct-2-en-3-yl]oxy]silane.

Molecular Properties

Compound Nametrimethyl-[[(1R,5S)-8-oxabicyclo[3.2.1]oct-2-en-3-yl]oxy]silane
PubChem CID10081462
Molecular FormulaC10H18O2Si
Molecular Weight198.34 g/mol
Exact Mass198.11
IUPAC Nametrimethyl-[[(1R,5S)-8-oxabicyclo[3.2.1]oct-2-en-3-yl]oxy]silane
SMILESC[Si](C)(C)OC1=C[C@H]2CC[C@@H](C1)O2
InChIInChI=1S/C10H18O2Si/c1-13(2,3)12-10-6-8-4-5-9(7-10)11-8/h6,8-9H,4-5,7H2,1-3H3/t8-,9+/m1/s1
InChIKeyLDDSYOHYZHNABX-BDAKNGLRSA-N
XLogP2.67
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.34
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 trimethyl-[[(1R,5S)-8-oxabicyclo[3.2.1]oct-2-en-3-yl]oxy]silane?
The IUPAC name of trimethyl-[[(1R,5S)-8-oxabicyclo[3.2.1]oct-2-en-3-yl]oxy]silane (CID 10081462) is trimethyl-[[(1R,5S)-8-oxabicyclo[3.2.1]oct-2-en-3-yl]oxy]silane.
What is the SMILES notation for trimethyl-[[(1R,5S)-8-oxabicyclo[3.2.1]oct-2-en-3-yl]oxy]silane?
The canonical SMILES for trimethyl-[[(1R,5S)-8-oxabicyclo[3.2.1]oct-2-en-3-yl]oxy]silane is C[Si](C)(C)OC1=C[C@H]2CC[C@@H](C1)O2.
What is the InChIKey of trimethyl-[[(1R,5S)-8-oxabicyclo[3.2.1]oct-2-en-3-yl]oxy]silane?
The InChIKey is LDDSYOHYZHNABX-BDAKNGLRSA-N. The full InChI is InChI=1S/C10H18O2Si/c1-13(2,3)12-10-6-8-4-5-9(7-10)11-8/h6,8-9H,4-5,7H2,1-3H3/t8-,9+/m1/s1.
What are the key properties of trimethyl-[[(1R,5S)-8-oxabicyclo[3.2.1]oct-2-en-3-yl]oxy]silane?
trimethyl-[[(1R,5S)-8-oxabicyclo[3.2.1]oct-2-en-3-yl]oxy]silane has a molecular weight of 198.34 g/mol, XLogP of 2.67, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[[(1R,5S)-8-oxabicyclo[3.2.1]oct-2-en-3-yl]oxy]silane is sourced from PubChem (CID 10081462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).