trimethyl-[(3S,5R)-9-oxabicyclo[3.3.1]nona-1,6-dien-3-yl]silane

C11H18OSi — CID 11636991

IUPACtrimethyl-[(3S,5R)-9-oxabicyclo[3.3.1]nona-1,6-dien-3-yl]silane
SMILESC[Si](C)(C)[C@@H]1C=C2CC=C[C@@H](C1)O2
InChIInChI=1S/C11H18OSi/c1-13(2,3)11-7-9-5-4-6-10(8-11)12-9/h4-5,8-9,11H,6-7H2,1-3H3/t9-,11-/m0/s1
InChIKeyAUMXNAYQGYYZLS-ONGXEEELSA-N
MW194.35 g/mol
LogP3.33
Rot. Bonds1

About trimethyl-[(3S,5R)-9-oxabicyclo[3.3.1]nona-1,6-dien-3-yl]silane

trimethyl-[(3S,5R)-9-oxabicyclo[3.3.1]nona-1,6-dien-3-yl]silane (PubChem CID 11636991) has the molecular formula C11H18OSi and a molecular weight of 194.35 g/mol. Its IUPAC name is trimethyl-[(3S,5R)-9-oxabicyclo[3.3.1]nona-1,6-dien-3-yl]silane.

Molecular Properties

Compound Nametrimethyl-[(3S,5R)-9-oxabicyclo[3.3.1]nona-1,6-dien-3-yl]silane
PubChem CID11636991
Molecular FormulaC11H18OSi
Molecular Weight194.35 g/mol
Exact Mass194.11
IUPAC Nametrimethyl-[(3S,5R)-9-oxabicyclo[3.3.1]nona-1,6-dien-3-yl]silane
SMILESC[Si](C)(C)[C@@H]1C=C2CC=C[C@@H](C1)O2
InChIInChI=1S/C11H18OSi/c1-13(2,3)11-7-9-5-4-6-10(8-11)12-9/h4-5,8-9,11H,6-7H2,1-3H3/t9-,11-/m0/s1
InChIKeyAUMXNAYQGYYZLS-ONGXEEELSA-N
XLogP3.33
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.35
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

9-Oxabicyclo[3.3.1]nona-4,7-diene
CID 129860474
6-Methyl-4-trimethylsilylmethyl-5,6-dihydro-2H-pyran
CID 13493655
trimethyl-[(1S,5R)-9-oxabicyclo[3.3.1]nona-2,6-dien-1-yl]silane
CID 11521247
trimethyl-[(3R,5R)-9-oxabicyclo[3.3.1]nona-1,6-dien-3-yl]stannane
CID 11529319
trimethyl-[(3S,5R)-9-oxabicyclo[3.3.1]nona-1,6-dien-3-yl]plumbane
CID 11675167
trimethyl-[(3S,5R)-9-oxabicyclo[3.3.1]nona-1,6-dien-3-yl]stannane
CID 11701934
trimethyl-(2-methyl-3,6-dihydro-2H-pyran-4-yl)silane
CID 12130353
trimethyl-[(3R,5R)-9-oxabicyclo[3.3.1]nona-1,6-dien-3-yl]plumbane
CID 177577077

Frequently Asked Questions

What is the IUPAC name of trimethyl-[(3S,5R)-9-oxabicyclo[3.3.1]nona-1,6-dien-3-yl]silane?
The IUPAC name of trimethyl-[(3S,5R)-9-oxabicyclo[3.3.1]nona-1,6-dien-3-yl]silane (CID 11636991) is trimethyl-[(3S,5R)-9-oxabicyclo[3.3.1]nona-1,6-dien-3-yl]silane.
What is the SMILES notation for trimethyl-[(3S,5R)-9-oxabicyclo[3.3.1]nona-1,6-dien-3-yl]silane?
The canonical SMILES for trimethyl-[(3S,5R)-9-oxabicyclo[3.3.1]nona-1,6-dien-3-yl]silane is C[Si](C)(C)[C@@H]1C=C2CC=C[C@@H](C1)O2.
What is the InChIKey of trimethyl-[(3S,5R)-9-oxabicyclo[3.3.1]nona-1,6-dien-3-yl]silane?
The InChIKey is AUMXNAYQGYYZLS-ONGXEEELSA-N. The full InChI is InChI=1S/C11H18OSi/c1-13(2,3)11-7-9-5-4-6-10(8-11)12-9/h4-5,8-9,11H,6-7H2,1-3H3/t9-,11-/m0/s1.
What are the key properties of trimethyl-[(3S,5R)-9-oxabicyclo[3.3.1]nona-1,6-dien-3-yl]silane?
trimethyl-[(3S,5R)-9-oxabicyclo[3.3.1]nona-1,6-dien-3-yl]silane has a molecular weight of 194.35 g/mol, XLogP of 3.33, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(3S,5R)-9-oxabicyclo[3.3.1]nona-1,6-dien-3-yl]silane is sourced from PubChem (CID 11636991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).