bis[3-(ethoxy-silyl) propyl]disulfide

C10H22O2S2Si2 — CID 57219165

IUPAC—
SMILESCCO[Si]CCCSSCCC[Si]OCC
InChIInChI=1S/C10H22O2S2Si2/c1-3-11-15-9-5-7-13-14-8-6-10-16-12-4-2/h3-10H2,1-2H3
InChIKeyBPQZWMNMHLHDOL-UHFFFAOYSA-N
MW294.59 g/mol
LogP3.30
Rot. Bonds13

About bis[3-(ethoxy-silyl) propyl]disulfide

bis[3-(ethoxy-silyl) propyl]disulfide (PubChem CID 57219165) has the molecular formula C10H22O2S2Si2 and a molecular weight of 294.59 g/mol.

Molecular Properties

Compound Namebis[3-(ethoxy-silyl) propyl]disulfide
PubChem CID57219165
Molecular FormulaC10H22O2S2Si2
Molecular Weight294.59 g/mol
Exact Mass294.06
IUPAC Name—
SMILESCCO[Si]CCCSSCCC[Si]OCC
InChIInChI=1S/C10H22O2S2Si2/c1-3-11-15-9-5-7-13-14-8-6-10-16-12-4-2/h3-10H2,1-2H3
InChIKeyBPQZWMNMHLHDOL-UHFFFAOYSA-N
XLogP3.30
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.59
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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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Frequently Asked Questions

What is the IUPAC name of bis[3-(ethoxy-silyl) propyl]disulfide?
The IUPAC name of bis[3-(ethoxy-silyl) propyl]disulfide (CID 57219165) is not available.
What is the SMILES notation for bis[3-(ethoxy-silyl) propyl]disulfide?
The canonical SMILES for bis[3-(ethoxy-silyl) propyl]disulfide is CCO[Si]CCCSSCCC[Si]OCC.
What is the InChIKey of bis[3-(ethoxy-silyl) propyl]disulfide?
The InChIKey is BPQZWMNMHLHDOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O2S2Si2/c1-3-11-15-9-5-7-13-14-8-6-10-16-12-4-2/h3-10H2,1-2H3.
What are the key properties of bis[3-(ethoxy-silyl) propyl]disulfide?
bis[3-(ethoxy-silyl) propyl]disulfide has a molecular weight of 294.59 g/mol, XLogP of 3.30, 13 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis[3-(ethoxy-silyl) propyl]disulfide is sourced from PubChem (CID 57219165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).