(6R,8R,11R)-8,11-bis(trimethylsilyloxymethyl)-2-oxaspiro[5.5]undec-9-en-1-one

C18H34O4Si2 — CID 15642288

IUPAC(6R,8R,11R)-8,11-bis(trimethylsilyloxymethyl)-2-oxaspiro[5.5]undec-9-en-1-one
SMILESC[Si](C)(C)OC[C@H]1C=C[C@@H](CO[Si](C)(C)C)[C@@]2(CCCOC2=O)C1
InChIInChI=1S/C18H34O4Si2/c1-23(2,3)21-13-15-8-9-16(14-22-24(4,5)6)18(12-15)10-7-11-20-17(18)19/h8-9,15-16H,7,10-14H2,1-6H3/t15-,16-,18+/m0/s1
InChIKeyMCUVKBGGWZVMBJ-XYJFISCASA-N
MW370.64 g/mol
LogP4.21
Rot. Bonds6

About (6R,8R,11R)-8,11-bis(trimethylsilyloxymethyl)-2-oxaspiro[5.5]undec-9-en-1-one

(6R,8R,11R)-8,11-bis(trimethylsilyloxymethyl)-2-oxaspiro[5.5]undec-9-en-1-one (PubChem CID 15642288) has the molecular formula C18H34O4Si2 and a molecular weight of 370.64 g/mol. Its IUPAC name is (6R,8R,11R)-8,11-bis(trimethylsilyloxymethyl)-2-oxaspiro[5.5]undec-9-en-1-one.

Molecular Properties

Compound Name(6R,8R,11R)-8,11-bis(trimethylsilyloxymethyl)-2-oxaspiro[5.5]undec-9-en-1-one
PubChem CID15642288
Molecular FormulaC18H34O4Si2
Molecular Weight370.64 g/mol
Exact Mass370.20
IUPAC Name(6R,8R,11R)-8,11-bis(trimethylsilyloxymethyl)-2-oxaspiro[5.5]undec-9-en-1-one
SMILESC[Si](C)(C)OC[C@H]1C=C[C@@H](CO[Si](C)(C)C)[C@@]2(CCCOC2=O)C1
InChIInChI=1S/C18H34O4Si2/c1-23(2,3)21-13-15-8-9-16(14-22-24(4,5)6)18(12-15)10-7-11-20-17(18)19/h8-9,15-16H,7,10-14H2,1-6H3/t15-,16-,18+/m0/s1
InChIKeyMCUVKBGGWZVMBJ-XYJFISCASA-N
XLogP4.21
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.64
LogP ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze (6R,8R,11R)-8,11-bis(trimethylsilyloxymethyl)-2-oxaspiro[5.5]undec-9-en-1-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (6R,8R,11R)-8,11-bis(trimethylsilyloxymethyl)-2-oxaspiro[5.5]undec-9-en-1-one?
The IUPAC name of (6R,8R,11R)-8,11-bis(trimethylsilyloxymethyl)-2-oxaspiro[5.5]undec-9-en-1-one (CID 15642288) is (6R,8R,11R)-8,11-bis(trimethylsilyloxymethyl)-2-oxaspiro[5.5]undec-9-en-1-one.
What is the SMILES notation for (6R,8R,11R)-8,11-bis(trimethylsilyloxymethyl)-2-oxaspiro[5.5]undec-9-en-1-one?
The canonical SMILES for (6R,8R,11R)-8,11-bis(trimethylsilyloxymethyl)-2-oxaspiro[5.5]undec-9-en-1-one is C[Si](C)(C)OC[C@H]1C=C[C@@H](CO[Si](C)(C)C)[C@@]2(CCCOC2=O)C1.
What is the InChIKey of (6R,8R,11R)-8,11-bis(trimethylsilyloxymethyl)-2-oxaspiro[5.5]undec-9-en-1-one?
The InChIKey is MCUVKBGGWZVMBJ-XYJFISCASA-N. The full InChI is InChI=1S/C18H34O4Si2/c1-23(2,3)21-13-15-8-9-16(14-22-24(4,5)6)18(12-15)10-7-11-20-17(18)19/h8-9,15-16H,7,10-14H2,1-6H3/t15-,16-,18+/m0/s1.
What are the key properties of (6R,8R,11R)-8,11-bis(trimethylsilyloxymethyl)-2-oxaspiro[5.5]undec-9-en-1-one?
(6R,8R,11R)-8,11-bis(trimethylsilyloxymethyl)-2-oxaspiro[5.5]undec-9-en-1-one has a molecular weight of 370.64 g/mol, XLogP of 4.21, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6R,8R,11R)-8,11-bis(trimethylsilyloxymethyl)-2-oxaspiro[5.5]undec-9-en-1-one is sourced from PubChem (CID 15642288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).