ethoxyethane;thiolane

C8H18OS — CID 70126133

IUPACethoxyethane;thiolane
SMILESC1CCSC1.CCOCC
InChIInChI=1S/C4H10O.C4H8S/c1-3-5-4-2;1-2-4-5-3-1/h3-4H2,1-2H3;1-4H2
InChIKeyRILOYKCQSXLTAK-UHFFFAOYSA-N
MW162.30 g/mol
LogP2.56
Rot. Bonds2

About ethoxyethane;thiolane

ethoxyethane;thiolane (PubChem CID 70126133) has the molecular formula C8H18OS and a molecular weight of 162.30 g/mol. Its IUPAC name is ethoxyethane;thiolane.

Molecular Properties

Compound Nameethoxyethane;thiolane
PubChem CID70126133
Molecular FormulaC8H18OS
Molecular Weight162.30 g/mol
Exact Mass162.11
IUPAC Nameethoxyethane;thiolane
SMILESC1CCSC1.CCOCC
InChIInChI=1S/C4H10O.C4H8S/c1-3-5-4-2;1-2-4-5-3-1/h3-4H2,1-2H3;1-4H2
InChIKeyRILOYKCQSXLTAK-UHFFFAOYSA-N
XLogP2.56
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.30
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethoxyethane;thiolane?
The IUPAC name of ethoxyethane;thiolane (CID 70126133) is ethoxyethane;thiolane.
What is the SMILES notation for ethoxyethane;thiolane?
The canonical SMILES for ethoxyethane;thiolane is C1CCSC1.CCOCC.
What is the InChIKey of ethoxyethane;thiolane?
The InChIKey is RILOYKCQSXLTAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10O.C4H8S/c1-3-5-4-2;1-2-4-5-3-1/h3-4H2,1-2H3;1-4H2.
What are the key properties of ethoxyethane;thiolane?
ethoxyethane;thiolane has a molecular weight of 162.30 g/mol, XLogP of 2.56, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxyethane;thiolane is sourced from PubChem (CID 70126133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).