bis(propylsulfanyl)silane

C6H16S2Si — CID 154016187

IUPACbis(propylsulfanyl)silane
SMILESCCCS[SiH2]SCCC
InChIInChI=1S/C6H16S2Si/c1-3-5-7-9-8-6-4-2/h3-6,9H2,1-2H3
InChIKeyOPPSLERLZKHBGN-UHFFFAOYSA-N
MW180.41 g/mol
LogP2.27
Rot. Bonds6

About bis(propylsulfanyl)silane

bis(propylsulfanyl)silane (PubChem CID 154016187) has the molecular formula C6H16S2Si and a molecular weight of 180.41 g/mol. Its IUPAC name is bis(propylsulfanyl)silane.

Molecular Properties

Compound Namebis(propylsulfanyl)silane
PubChem CID154016187
Molecular FormulaC6H16S2Si
Molecular Weight180.41 g/mol
Exact Mass180.05
IUPAC Namebis(propylsulfanyl)silane
SMILESCCCS[SiH2]SCCC
InChIInChI=1S/C6H16S2Si/c1-3-5-7-9-8-6-4-2/h3-6,9H2,1-2H3
InChIKeyOPPSLERLZKHBGN-UHFFFAOYSA-N
XLogP2.27
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.41
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze bis(propylsulfanyl)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 bis(propylsulfanyl)silane?
The IUPAC name of bis(propylsulfanyl)silane (CID 154016187) is bis(propylsulfanyl)silane.
What is the SMILES notation for bis(propylsulfanyl)silane?
The canonical SMILES for bis(propylsulfanyl)silane is CCCS[SiH2]SCCC.
What is the InChIKey of bis(propylsulfanyl)silane?
The InChIKey is OPPSLERLZKHBGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H16S2Si/c1-3-5-7-9-8-6-4-2/h3-6,9H2,1-2H3.
What are the key properties of bis(propylsulfanyl)silane?
bis(propylsulfanyl)silane has a molecular weight of 180.41 g/mol, XLogP of 2.27, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis(propylsulfanyl)silane is sourced from PubChem (CID 154016187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).