11,11-dimethyl-5H-benzo[d][1,3,2]benzodioxasilocine

C15H16O2Si — CID 15790829

IUPAC11,11-dimethyl-5H-benzo[d][1,3,2]benzodioxasilocine
SMILESC[Si]1(C)Oc2ccccc2Cc2ccccc2O1
InChIInChI=1S/C15H16O2Si/c1-18(2)16-14-9-5-3-7-12(14)11-13-8-4-6-10-15(13)17-18/h3-10H,11H2,1-2H3
InChIKeyGQWNJMGZNXSOGC-UHFFFAOYSA-N
MW256.38 g/mol
LogP3.75
Rot. Bonds

About 11,11-dimethyl-5H-benzo[d][1,3,2]benzodioxasilocine

11,11-dimethyl-5H-benzo[d][1,3,2]benzodioxasilocine (PubChem CID 15790829) has the molecular formula C15H16O2Si and a molecular weight of 256.38 g/mol. Its IUPAC name is 11,11-dimethyl-5H-benzo[d][1,3,2]benzodioxasilocine.

Molecular Properties

Compound Name11,11-dimethyl-5H-benzo[d][1,3,2]benzodioxasilocine
PubChem CID15790829
Molecular FormulaC15H16O2Si
Molecular Weight256.38 g/mol
Exact Mass256.09
IUPAC Name11,11-dimethyl-5H-benzo[d][1,3,2]benzodioxasilocine
SMILESC[Si]1(C)Oc2ccccc2Cc2ccccc2O1
InChIInChI=1S/C15H16O2Si/c1-18(2)16-14-9-5-3-7-12(14)11-13-8-4-6-10-15(13)17-18/h3-10H,11H2,1-2H3
InChIKeyGQWNJMGZNXSOGC-UHFFFAOYSA-N
XLogP3.75
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.38
LogP ≤ 53.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 11,11-dimethyl-5H-benzo[d][1,3,2]benzodioxasilocine with MolForge

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

Launch Full Analysis

Related Compounds

9H-xanthene
CID 7107
9,12-dioxatricyclo[11.4.0.03,8]heptadeca-1(17),3,5,7,13,15-hexaene
CID 20671322
biphenylene;9H-xanthene
CID 69049558
5,8-dihydrochromeno[3,2-c]xanthene;ethane;methanol
CID 162075419
anthracene;9H-xanthene
CID 141402821
13,13,14,14-tetramethyl-2-oxatetracyclo[8.6.0.03,8.012,15]hexadeca-1(16),3,5,7,10,12(15)-hexaene
CID 146512597
12,14-dihydrochromeno[3,2-b]xanthene;ethane;methanol
CID 160728687
9,10-dihydroanthracene;methanamine
CID 123513741
sulfuric acid;9H-xanthene
CID 69337657
bicyclo[4.1.0]hepta-1,3,5-triene;methane
CID 157397080
bicyclo[8.1.0]undeca-1,3,5,7,9-pentaene
CID 91124939
ethane;4H-pyran;9H-xanthene
CID 159470126

Frequently Asked Questions

What is the IUPAC name of 11,11-dimethyl-5H-benzo[d][1,3,2]benzodioxasilocine?
The IUPAC name of 11,11-dimethyl-5H-benzo[d][1,3,2]benzodioxasilocine (CID 15790829) is 11,11-dimethyl-5H-benzo[d][1,3,2]benzodioxasilocine.
What is the SMILES notation for 11,11-dimethyl-5H-benzo[d][1,3,2]benzodioxasilocine?
The canonical SMILES for 11,11-dimethyl-5H-benzo[d][1,3,2]benzodioxasilocine is C[Si]1(C)Oc2ccccc2Cc2ccccc2O1.
What is the InChIKey of 11,11-dimethyl-5H-benzo[d][1,3,2]benzodioxasilocine?
The InChIKey is GQWNJMGZNXSOGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O2Si/c1-18(2)16-14-9-5-3-7-12(14)11-13-8-4-6-10-15(13)17-18/h3-10H,11H2,1-2H3.
What are the key properties of 11,11-dimethyl-5H-benzo[d][1,3,2]benzodioxasilocine?
11,11-dimethyl-5H-benzo[d][1,3,2]benzodioxasilocine has a molecular weight of 256.38 g/mol, XLogP of 3.75, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 11,11-dimethyl-5H-benzo[d][1,3,2]benzodioxasilocine is sourced from PubChem (CID 15790829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).