3-[[dimethyl(silyloxy)silyl]silyloxy-methylsilyl]propane-1-thiol

C6H22O2SSi4 — CID 173293784

IUPAC3-[[dimethyl(silyloxy)silyl]silyloxy-methylsilyl]propane-1-thiol
SMILESC[SiH](CCCS)O[SiH2][Si](C)(C)O[SiH3]
InChIInChI=1S/C6H22O2SSi4/c1-12(6-4-5-9)8-11-13(2,3)7-10/h9,12H,4-6,11H2,1-3,10H3
InChIKeyJGDXVXVDNHKNBM-UHFFFAOYSA-N
MW270.65 g/mol
LogP-0.24
Rot. Bonds7

About 3-[[dimethyl(silyloxy)silyl]silyloxy-methylsilyl]propane-1-thiol

3-[[dimethyl(silyloxy)silyl]silyloxy-methylsilyl]propane-1-thiol (PubChem CID 173293784) has the molecular formula C6H22O2SSi4 and a molecular weight of 270.65 g/mol. Its IUPAC name is 3-[[dimethyl(silyloxy)silyl]silyloxy-methylsilyl]propane-1-thiol.

Molecular Properties

Compound Name3-[[dimethyl(silyloxy)silyl]silyloxy-methylsilyl]propane-1-thiol
PubChem CID173293784
Molecular FormulaC6H22O2SSi4
Molecular Weight270.65 g/mol
Exact Mass270.04
IUPAC Name3-[[dimethyl(silyloxy)silyl]silyloxy-methylsilyl]propane-1-thiol
SMILESC[SiH](CCCS)O[SiH2][Si](C)(C)O[SiH3]
InChIInChI=1S/C6H22O2SSi4/c1-12(6-4-5-9)8-11-13(2,3)7-10/h9,12H,4-6,11H2,1-3,10H3
InChIKeyJGDXVXVDNHKNBM-UHFFFAOYSA-N
XLogP-0.24
TPSA18.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.65
LogP ≤ 5-0.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-[[dimethyl(silyloxy)silyl]silyloxy-methylsilyl]propane-1-thiol?
The IUPAC name of 3-[[dimethyl(silyloxy)silyl]silyloxy-methylsilyl]propane-1-thiol (CID 173293784) is 3-[[dimethyl(silyloxy)silyl]silyloxy-methylsilyl]propane-1-thiol.
What is the SMILES notation for 3-[[dimethyl(silyloxy)silyl]silyloxy-methylsilyl]propane-1-thiol?
The canonical SMILES for 3-[[dimethyl(silyloxy)silyl]silyloxy-methylsilyl]propane-1-thiol is C[SiH](CCCS)O[SiH2][Si](C)(C)O[SiH3].
What is the InChIKey of 3-[[dimethyl(silyloxy)silyl]silyloxy-methylsilyl]propane-1-thiol?
The InChIKey is JGDXVXVDNHKNBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H22O2SSi4/c1-12(6-4-5-9)8-11-13(2,3)7-10/h9,12H,4-6,11H2,1-3,10H3.
What are the key properties of 3-[[dimethyl(silyloxy)silyl]silyloxy-methylsilyl]propane-1-thiol?
3-[[dimethyl(silyloxy)silyl]silyloxy-methylsilyl]propane-1-thiol has a molecular weight of 270.65 g/mol, XLogP of -0.24, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[dimethyl(silyloxy)silyl]silyloxy-methylsilyl]propane-1-thiol is sourced from PubChem (CID 173293784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).