methoxysilane;3-trimethoxysilylpropane-1-thiol

C7H22O4SSi2 — CID 159282463

IUPACmethoxysilane;3-trimethoxysilylpropane-1-thiol
SMILESCO[SiH3].CO[Si](CCCS)(OC)OC
InChIInChI=1S/C6H16O3SSi.CH6OSi/c1-7-11(8-2,9-3)6-4-5-10;1-2-3/h10H,4-6H2,1-3H3;1,3H3
InChIKeyKZCCRLMKHURABJ-UHFFFAOYSA-N
MW258.49 g/mol
LogP0.10
Rot. Bonds6

About methoxysilane;3-trimethoxysilylpropane-1-thiol

methoxysilane;3-trimethoxysilylpropane-1-thiol (PubChem CID 159282463) has the molecular formula C7H22O4SSi2 and a molecular weight of 258.49 g/mol. Its IUPAC name is methoxysilane;3-trimethoxysilylpropane-1-thiol.

Molecular Properties

Compound Namemethoxysilane;3-trimethoxysilylpropane-1-thiol
PubChem CID159282463
Molecular FormulaC7H22O4SSi2
Molecular Weight258.49 g/mol
Exact Mass258.08
IUPAC Namemethoxysilane;3-trimethoxysilylpropane-1-thiol
SMILESCO[SiH3].CO[Si](CCCS)(OC)OC
InChIInChI=1S/C6H16O3SSi.CH6OSi/c1-7-11(8-2,9-3)6-4-5-10;1-2-3/h10H,4-6H2,1-3H3;1,3H3
InChIKeyKZCCRLMKHURABJ-UHFFFAOYSA-N
XLogP0.10
TPSA36.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.49
LogP ≤ 50.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

silane;3-trimethoxysilylpropane-1-thiol
CID 157336747
hydron;3-trimethoxysilylpropane-1-thiol
CID 174944178
5,5-dimethoxyhexane-1-thiol;3-trimethoxysilylpropane-1-thiol
CID 157162585
3-sulfanylpropanoic acid;3-trimethoxysilylpropane-1-thiol
CID 88693959
18-[diethoxy(methoxy)silyl]octadecane-1-thiol
CID 87149231
trimethoxy(6-trimethoxysilylhexyl)silane
CID 158013726
3-(2-trimethoxysilylethylsulfanyl)propane-1-thiol
CID 86093563
3-tris(trimethylsilyloxy)silylpropane-1-thiol
CID 18003138
azane;3-triethoxysilylpropane-1-thiol
CID 174882567
trimethoxy-[3-[methyl(silyloxy)silyl]propyl]silane
CID 173267859
methanol;3-trimethoxysilylpropan-1-amine;hydrochloride
CID 174963553
tert-butyl-chloro-dimethylsilane;tert-butyl-dimethyl-(3-trimethoxysilylpropylsulfanyl)silane;3-trimethoxysilylpropane-1-thiol
CID 167567175

Frequently Asked Questions

What is the IUPAC name of methoxysilane;3-trimethoxysilylpropane-1-thiol?
The IUPAC name of methoxysilane;3-trimethoxysilylpropane-1-thiol (CID 159282463) is methoxysilane;3-trimethoxysilylpropane-1-thiol.
What is the SMILES notation for methoxysilane;3-trimethoxysilylpropane-1-thiol?
The canonical SMILES for methoxysilane;3-trimethoxysilylpropane-1-thiol is CO[SiH3].CO[Si](CCCS)(OC)OC.
What is the InChIKey of methoxysilane;3-trimethoxysilylpropane-1-thiol?
The InChIKey is KZCCRLMKHURABJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H16O3SSi.CH6OSi/c1-7-11(8-2,9-3)6-4-5-10;1-2-3/h10H,4-6H2,1-3H3;1,3H3.
What are the key properties of methoxysilane;3-trimethoxysilylpropane-1-thiol?
methoxysilane;3-trimethoxysilylpropane-1-thiol has a molecular weight of 258.49 g/mol, XLogP of 0.10, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methoxysilane;3-trimethoxysilylpropane-1-thiol is sourced from PubChem (CID 159282463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).