ethoxy-ethyl-ethylsulfanylphosphane

C6H15OPS — CID 134977082

IUPACethoxy-ethyl-ethylsulfanylphosphane
SMILESCCOP(CC)SCC
InChIInChI=1S/C6H15OPS/c1-4-7-8(5-2)9-6-3/h4-6H2,1-3H3
InChIKeyWJWIOOSSUGTETK-UHFFFAOYSA-N
MW166.23 g/mol
LogP3.11
Rot. Bonds5

About ethoxy-ethyl-ethylsulfanylphosphane

ethoxy-ethyl-ethylsulfanylphosphane (PubChem CID 134977082) has the molecular formula C6H15OPS and a molecular weight of 166.23 g/mol. Its IUPAC name is ethoxy-ethyl-ethylsulfanylphosphane.

Molecular Properties

Compound Nameethoxy-ethyl-ethylsulfanylphosphane
PubChem CID134977082
Molecular FormulaC6H15OPS
Molecular Weight166.23 g/mol
Exact Mass166.06
IUPAC Nameethoxy-ethyl-ethylsulfanylphosphane
SMILESCCOP(CC)SCC
InChIInChI=1S/C6H15OPS/c1-4-7-8(5-2)9-6-3/h4-6H2,1-3H3
InChIKeyWJWIOOSSUGTETK-UHFFFAOYSA-N
XLogP3.11
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.23
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of ethoxy-ethyl-ethylsulfanylphosphane?
The IUPAC name of ethoxy-ethyl-ethylsulfanylphosphane (CID 134977082) is ethoxy-ethyl-ethylsulfanylphosphane.
What is the SMILES notation for ethoxy-ethyl-ethylsulfanylphosphane?
The canonical SMILES for ethoxy-ethyl-ethylsulfanylphosphane is CCOP(CC)SCC.
What is the InChIKey of ethoxy-ethyl-ethylsulfanylphosphane?
The InChIKey is WJWIOOSSUGTETK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15OPS/c1-4-7-8(5-2)9-6-3/h4-6H2,1-3H3.
What are the key properties of ethoxy-ethyl-ethylsulfanylphosphane?
ethoxy-ethyl-ethylsulfanylphosphane has a molecular weight of 166.23 g/mol, XLogP of 3.11, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxy-ethyl-ethylsulfanylphosphane is sourced from PubChem (CID 134977082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).