3-(2-ethenylsulfanylethylsulfanyl)propyl-trimethoxysilane

C10H22O3S2Si — CID 71381592

IUPAC3-(2-ethenylsulfanylethylsulfanyl)propyl-trimethoxysilane
SMILESC=CSCCSCCC[Si](OC)(OC)OC
InChIInChI=1S/C10H22O3S2Si/c1-5-14-8-9-15-7-6-10-16(11-2,12-3)13-4/h5H,1,6-10H2,2-4H3
InChIKeyRRQFELDYKVADDO-UHFFFAOYSA-N
MW282.50 g/mol
LogP2.86
Rot. Bonds11

About 3-(2-ethenylsulfanylethylsulfanyl)propyl-trimethoxysilane

3-(2-ethenylsulfanylethylsulfanyl)propyl-trimethoxysilane (PubChem CID 71381592) has the molecular formula C10H22O3S2Si and a molecular weight of 282.50 g/mol. Its IUPAC name is 3-(2-ethenylsulfanylethylsulfanyl)propyl-trimethoxysilane.

Molecular Properties

Compound Name3-(2-ethenylsulfanylethylsulfanyl)propyl-trimethoxysilane
PubChem CID71381592
Molecular FormulaC10H22O3S2Si
Molecular Weight282.50 g/mol
Exact Mass282.08
IUPAC Name3-(2-ethenylsulfanylethylsulfanyl)propyl-trimethoxysilane
SMILESC=CSCCSCCC[Si](OC)(OC)OC
InChIInChI=1S/C10H22O3S2Si/c1-5-14-8-9-15-7-6-10-16(11-2,12-3)13-4/h5H,1,6-10H2,2-4H3
InChIKeyRRQFELDYKVADDO-UHFFFAOYSA-N
XLogP2.86
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.50
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-(2-ethenylsulfanylethylsulfanyl)propyl-trimethoxysilane?
The IUPAC name of 3-(2-ethenylsulfanylethylsulfanyl)propyl-trimethoxysilane (CID 71381592) is 3-(2-ethenylsulfanylethylsulfanyl)propyl-trimethoxysilane.
What is the SMILES notation for 3-(2-ethenylsulfanylethylsulfanyl)propyl-trimethoxysilane?
The canonical SMILES for 3-(2-ethenylsulfanylethylsulfanyl)propyl-trimethoxysilane is C=CSCCSCCC[Si](OC)(OC)OC.
What is the InChIKey of 3-(2-ethenylsulfanylethylsulfanyl)propyl-trimethoxysilane?
The InChIKey is RRQFELDYKVADDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O3S2Si/c1-5-14-8-9-15-7-6-10-16(11-2,12-3)13-4/h5H,1,6-10H2,2-4H3.
What are the key properties of 3-(2-ethenylsulfanylethylsulfanyl)propyl-trimethoxysilane?
3-(2-ethenylsulfanylethylsulfanyl)propyl-trimethoxysilane has a molecular weight of 282.50 g/mol, XLogP of 2.86, 11 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-ethenylsulfanylethylsulfanyl)propyl-trimethoxysilane is sourced from PubChem (CID 71381592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).