(6Z)-2,2-di(propan-2-yl)-4,5,8,9-tetrahydro-1,3,2-dioxasilonine

C12H24O2Si — CID 139030244

IUPAC(6Z)-2,2-di(propan-2-yl)-4,5,8,9-tetrahydro-1,3,2-dioxasilonine
SMILESCC(C)[Si]1(C(C)C)OCC/C=C\CCO1
InChIInChI=1S/C12H24O2Si/c1-11(2)15(12(3)4)13-9-7-5-6-8-10-14-15/h5-6,11-12H,7-10H2,1-4H3/b6-5-
InChIKeyZAJGAXQLMDOTJJ-WAYWQWQTSA-N
MW228.41 g/mol
LogP3.63
Rot. Bonds2

About (6Z)-2,2-di(propan-2-yl)-4,5,8,9-tetrahydro-1,3,2-dioxasilonine

(6Z)-2,2-di(propan-2-yl)-4,5,8,9-tetrahydro-1,3,2-dioxasilonine (PubChem CID 139030244) has the molecular formula C12H24O2Si and a molecular weight of 228.41 g/mol. Its IUPAC name is (6Z)-2,2-di(propan-2-yl)-4,5,8,9-tetrahydro-1,3,2-dioxasilonine.

Molecular Properties

Compound Name(6Z)-2,2-di(propan-2-yl)-4,5,8,9-tetrahydro-1,3,2-dioxasilonine
PubChem CID139030244
Molecular FormulaC12H24O2Si
Molecular Weight228.41 g/mol
Exact Mass228.15
IUPAC Name(6Z)-2,2-di(propan-2-yl)-4,5,8,9-tetrahydro-1,3,2-dioxasilonine
SMILESCC(C)[Si]1(C(C)C)OCC/C=C\CCO1
InChIInChI=1S/C12H24O2Si/c1-11(2)15(12(3)4)13-9-7-5-6-8-10-14-15/h5-6,11-12H,7-10H2,1-4H3/b6-5-
InChIKeyZAJGAXQLMDOTJJ-WAYWQWQTSA-N
XLogP3.63
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.41
LogP ≤ 53.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (6Z)-2,2-di(propan-2-yl)-4,5,8,9-tetrahydro-1,3,2-dioxasilonine 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 (6Z)-2,2-di(propan-2-yl)-4,5,8,9-tetrahydro-1,3,2-dioxasilonine?
The IUPAC name of (6Z)-2,2-di(propan-2-yl)-4,5,8,9-tetrahydro-1,3,2-dioxasilonine (CID 139030244) is (6Z)-2,2-di(propan-2-yl)-4,5,8,9-tetrahydro-1,3,2-dioxasilonine.
What is the SMILES notation for (6Z)-2,2-di(propan-2-yl)-4,5,8,9-tetrahydro-1,3,2-dioxasilonine?
The canonical SMILES for (6Z)-2,2-di(propan-2-yl)-4,5,8,9-tetrahydro-1,3,2-dioxasilonine is CC(C)[Si]1(C(C)C)OCC/C=C\CCO1.
What is the InChIKey of (6Z)-2,2-di(propan-2-yl)-4,5,8,9-tetrahydro-1,3,2-dioxasilonine?
The InChIKey is ZAJGAXQLMDOTJJ-WAYWQWQTSA-N. The full InChI is InChI=1S/C12H24O2Si/c1-11(2)15(12(3)4)13-9-7-5-6-8-10-14-15/h5-6,11-12H,7-10H2,1-4H3/b6-5-.
What are the key properties of (6Z)-2,2-di(propan-2-yl)-4,5,8,9-tetrahydro-1,3,2-dioxasilonine?
(6Z)-2,2-di(propan-2-yl)-4,5,8,9-tetrahydro-1,3,2-dioxasilonine has a molecular weight of 228.41 g/mol, XLogP of 3.63, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6Z)-2,2-di(propan-2-yl)-4,5,8,9-tetrahydro-1,3,2-dioxasilonine is sourced from PubChem (CID 139030244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).