trihydroxy-[3-(3-trihydroxysilylpropyldisulfanyl)propyl]silane

C6H18O6S2Si2 — CID 156822109

IUPACtrihydroxy-[3-(3-trihydroxysilylpropyldisulfanyl)propyl]silane
SMILESO[Si](O)(O)CCCSSCCC[Si](O)(O)O
InChIInChI=1S/C6H18O6S2Si2/c7-15(8,9)5-1-3-13-14-4-2-6-16(10,11)12/h7-12H,1-6H2
InChIKeyWSUBJFFVCHTINY-UHFFFAOYSA-N
MW306.51 g/mol
LogP-1.02
Rot. Bonds9

About trihydroxy-[3-(3-trihydroxysilylpropyldisulfanyl)propyl]silane

trihydroxy-[3-(3-trihydroxysilylpropyldisulfanyl)propyl]silane (PubChem CID 156822109) has the molecular formula C6H18O6S2Si2 and a molecular weight of 306.51 g/mol. Its IUPAC name is trihydroxy-[3-(3-trihydroxysilylpropyldisulfanyl)propyl]silane.

Molecular Properties

Compound Nametrihydroxy-[3-(3-trihydroxysilylpropyldisulfanyl)propyl]silane
PubChem CID156822109
Molecular FormulaC6H18O6S2Si2
Molecular Weight306.51 g/mol
Exact Mass306.01
IUPAC Nametrihydroxy-[3-(3-trihydroxysilylpropyldisulfanyl)propyl]silane
SMILESO[Si](O)(O)CCCSSCCC[Si](O)(O)O
InChIInChI=1S/C6H18O6S2Si2/c7-15(8,9)5-1-3-13-14-4-2-6-16(10,11)12/h7-12H,1-6H2
InChIKeyWSUBJFFVCHTINY-UHFFFAOYSA-N
XLogP-1.02
TPSA121.38 Ų
H-Bond Donors6
H-Bond Acceptors8
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500306.51
LogP ≤ 5-1.02
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Related Compounds

hydroxy-[3-[3-[hydroxy(dimethoxy)silyl]propyldisulfanyl]propyl]-dimethoxysilane
CID 140958062
3-trihydroxysilylpropane-1-thiol
CID 15787898
6-trihydroxysilylhexan-1-amine
CID 87680718
trihydroxy(6-iodohexyl)silane
CID 58330305
4-trihydroxysilylbutanoic acid
CID 102401251
3-(butyldisulfanyl)propyl-trimethoxysilane
CID 14765024
disilyloxy-silylperoxy-[3-(3-trisilyloxysilylpropyldisulfanyl)propyl]silane
CID 123666080
CID 58741507
CID 58741507
3-azidopropyl(trihydroxy)silane
CID 135039230
N-methyl-12-trihydroxysilyldodecan-1-amine
CID 87686187
trimethoxy-[12-(12-trimethoxysilyldodecyldisulfanyl)dodecyl]silane
CID 87873145
acetic acid;palladium;2-(3-trihydroxysilylpropylsulfanyl)aniline
CID 139211865

Frequently Asked Questions

What is the IUPAC name of trihydroxy-[3-(3-trihydroxysilylpropyldisulfanyl)propyl]silane?
The IUPAC name of trihydroxy-[3-(3-trihydroxysilylpropyldisulfanyl)propyl]silane (CID 156822109) is trihydroxy-[3-(3-trihydroxysilylpropyldisulfanyl)propyl]silane.
What is the SMILES notation for trihydroxy-[3-(3-trihydroxysilylpropyldisulfanyl)propyl]silane?
The canonical SMILES for trihydroxy-[3-(3-trihydroxysilylpropyldisulfanyl)propyl]silane is O[Si](O)(O)CCCSSCCC[Si](O)(O)O.
What is the InChIKey of trihydroxy-[3-(3-trihydroxysilylpropyldisulfanyl)propyl]silane?
The InChIKey is WSUBJFFVCHTINY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H18O6S2Si2/c7-15(8,9)5-1-3-13-14-4-2-6-16(10,11)12/h7-12H,1-6H2.
What are the key properties of trihydroxy-[3-(3-trihydroxysilylpropyldisulfanyl)propyl]silane?
trihydroxy-[3-(3-trihydroxysilylpropyldisulfanyl)propyl]silane has a molecular weight of 306.51 g/mol, XLogP of -1.02, 9 rotatable bonds, 6 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for trihydroxy-[3-(3-trihydroxysilylpropyldisulfanyl)propyl]silane is sourced from PubChem (CID 156822109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).