3-hydroxysilyloxysilylpropane-1-thiol

C3H12O2SSi2 — CID 123377312

IUPAC3-hydroxysilyloxysilylpropane-1-thiol
SMILESO[SiH2]O[SiH2]CCCS
InChIInChI=1S/C3H12O2SSi2/c4-8-5-7-3-1-2-6/h4,6H,1-3,7-8H2
InChIKeyAMDNFDPLZHAEEA-UHFFFAOYSA-N
MW168.37 g/mol
LogP-1.18
Rot. Bonds5

About 3-hydroxysilyloxysilylpropane-1-thiol

3-hydroxysilyloxysilylpropane-1-thiol (PubChem CID 123377312) has the molecular formula C3H12O2SSi2 and a molecular weight of 168.37 g/mol. Its IUPAC name is 3-hydroxysilyloxysilylpropane-1-thiol.

Molecular Properties

Compound Name3-hydroxysilyloxysilylpropane-1-thiol
PubChem CID123377312
Molecular FormulaC3H12O2SSi2
Molecular Weight168.37 g/mol
Exact Mass168.01
IUPAC Name3-hydroxysilyloxysilylpropane-1-thiol
SMILESO[SiH2]O[SiH2]CCCS
InChIInChI=1S/C3H12O2SSi2/c4-8-5-7-3-1-2-6/h4,6H,1-3,7-8H2
InChIKeyAMDNFDPLZHAEEA-UHFFFAOYSA-N
XLogP-1.18
TPSA29.46 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.37
LogP ≤ 5-1.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 3-hydroxysilyloxysilylpropane-1-thiol 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

4-(2,2-dimethoxyethoxysilyl)butane-1-thiol
CID 154430039
3-(diethoxymethoxymethoxysilyl)propane-1-thiol
CID 172693779
3-(2-methoxyethoxymethylsilyl)propane-1-thiol
CID 175584892
3-[[[dimethyl(3-sulfanylpropyl)silyl]oxy-methyl-(3-sulfanylpropyl)silyl]oxy-methyl-(3-sulfanylpropyl)silyl]oxysilylpropane-1-thiol
CID 123346721
3-(1,3-diethoxypropoxysilyl)propane-1-thiol
CID 175446121
octyl(octylsilyloxy)silane
CID 151438773
octatriacontane-1,38-dithiol
CID 154319638
tetracosane-1,24-dithiol
CID 87293915
5-sulfanylpentylsilyl 18-methylnonadecanoate
CID 150103943
sodium ethane-1,2-dithiol
CID 54604412
3-[bis(2-methylpropoxy)methylsilyl]propane-1-thiol
CID 123821142
nonane-1,9-dithiol;silver
CID 87575502

Frequently Asked Questions

What is the IUPAC name of 3-hydroxysilyloxysilylpropane-1-thiol?
The IUPAC name of 3-hydroxysilyloxysilylpropane-1-thiol (CID 123377312) is 3-hydroxysilyloxysilylpropane-1-thiol.
What is the SMILES notation for 3-hydroxysilyloxysilylpropane-1-thiol?
The canonical SMILES for 3-hydroxysilyloxysilylpropane-1-thiol is O[SiH2]O[SiH2]CCCS.
What is the InChIKey of 3-hydroxysilyloxysilylpropane-1-thiol?
The InChIKey is AMDNFDPLZHAEEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H12O2SSi2/c4-8-5-7-3-1-2-6/h4,6H,1-3,7-8H2.
What are the key properties of 3-hydroxysilyloxysilylpropane-1-thiol?
3-hydroxysilyloxysilylpropane-1-thiol has a molecular weight of 168.37 g/mol, XLogP of -1.18, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxysilyloxysilylpropane-1-thiol is sourced from PubChem (CID 123377312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).