triethoxysulfanium

C6H15O3S+ — CID 19853880

IUPACtriethoxysulfanium
SMILESCCO[S+](OCC)OCC
InChIInChI=1S/C6H15O3S/c1-4-7-10(8-5-2)9-6-3/h4-6H2,1-3H3/q+1
InChIKeyMJUXBCICAGPQDB-UHFFFAOYSA-N
MW167.25 g/mol
LogP1.46
Rot. Bonds6

About triethoxysulfanium

triethoxysulfanium (PubChem CID 19853880) has the molecular formula C6H15O3S+ and a molecular weight of 167.25 g/mol. Its IUPAC name is triethoxysulfanium.

Molecular Properties

Compound Nametriethoxysulfanium
PubChem CID19853880
Molecular FormulaC6H15O3S+
Molecular Weight167.25 g/mol
Exact Mass167.07
IUPAC Nametriethoxysulfanium
SMILESCCO[S+](OCC)OCC
InChIInChI=1S/C6H15O3S/c1-4-7-10(8-5-2)9-6-3/h4-6H2,1-3H3/q+1
InChIKeyMJUXBCICAGPQDB-UHFFFAOYSA-N
XLogP1.46
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 51.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Aluminum ethylate
CID 11153
Antimony triethoxide
CID 66326
Sulfurous acid, diethyl ester
CID 12197
Magnesium ethanolate
CID 164963
Copper(II) ethoxide
CID 14419876
Triethyl arsenite
CID 76591
Diethyl peroxide
CID 61175
Dipropyl Sulfite
CID 136434
Disulfide, dipropoxy
CID 316389
Triethyl stibenite
CID 16686007
Disulfide, diethoxy
CID 10898917
Calcium diethanolate
CID 6451473

Frequently Asked Questions

What is the IUPAC name of triethoxysulfanium?
The IUPAC name of triethoxysulfanium (CID 19853880) is triethoxysulfanium.
What is the SMILES notation for triethoxysulfanium?
The canonical SMILES for triethoxysulfanium is CCO[S+](OCC)OCC.
What is the InChIKey of triethoxysulfanium?
The InChIKey is MJUXBCICAGPQDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15O3S/c1-4-7-10(8-5-2)9-6-3/h4-6H2,1-3H3/q+1.
What are the key properties of triethoxysulfanium?
triethoxysulfanium has a molecular weight of 167.25 g/mol, XLogP of 1.46, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxysulfanium is sourced from PubChem (CID 19853880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).