trimethyl(oxan-2-ylsulfanylmethyl)silane

C9H20OSSi — CID 13498367

IUPACtrimethyl(oxan-2-ylsulfanylmethyl)silane
SMILESC[Si](C)(C)CSC1CCCCO1
InChIInChI=1S/C9H20OSSi/c1-12(2,3)8-11-9-6-4-5-7-10-9/h9H,4-8H2,1-3H3
InChIKeyCBGNMERHCKSEBS-UHFFFAOYSA-N
MW204.41 g/mol
LogP3.12
Rot. Bonds3

About trimethyl(oxan-2-ylsulfanylmethyl)silane

trimethyl(oxan-2-ylsulfanylmethyl)silane (PubChem CID 13498367) has the molecular formula C9H20OSSi and a molecular weight of 204.41 g/mol. Its IUPAC name is trimethyl(oxan-2-ylsulfanylmethyl)silane.

Molecular Properties

Compound Nametrimethyl(oxan-2-ylsulfanylmethyl)silane
PubChem CID13498367
Molecular FormulaC9H20OSSi
Molecular Weight204.41 g/mol
Exact Mass204.10
IUPAC Nametrimethyl(oxan-2-ylsulfanylmethyl)silane
SMILESC[Si](C)(C)CSC1CCCCO1
InChIInChI=1S/C9H20OSSi/c1-12(2,3)8-11-9-6-4-5-7-10-9/h9H,4-8H2,1-3H3
InChIKeyCBGNMERHCKSEBS-UHFFFAOYSA-N
XLogP3.12
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.41
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze trimethyl(oxan-2-ylsulfanylmethyl)silane 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 trimethyl(oxan-2-ylsulfanylmethyl)silane?
The IUPAC name of trimethyl(oxan-2-ylsulfanylmethyl)silane (CID 13498367) is trimethyl(oxan-2-ylsulfanylmethyl)silane.
What is the SMILES notation for trimethyl(oxan-2-ylsulfanylmethyl)silane?
The canonical SMILES for trimethyl(oxan-2-ylsulfanylmethyl)silane is C[Si](C)(C)CSC1CCCCO1.
What is the InChIKey of trimethyl(oxan-2-ylsulfanylmethyl)silane?
The InChIKey is CBGNMERHCKSEBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20OSSi/c1-12(2,3)8-11-9-6-4-5-7-10-9/h9H,4-8H2,1-3H3.
What are the key properties of trimethyl(oxan-2-ylsulfanylmethyl)silane?
trimethyl(oxan-2-ylsulfanylmethyl)silane has a molecular weight of 204.41 g/mol, XLogP of 3.12, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl(oxan-2-ylsulfanylmethyl)silane is sourced from PubChem (CID 13498367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).