(2R)-2-ethyl-5-ethylsulfanyl-3,3-dimethyloxolane

C10H20OS — CID 89397464

IUPAC(2R)-2-ethyl-5-ethylsulfanyl-3,3-dimethyloxolane
SMILESCCSC1CC(C)(C)[C@@H](CC)O1
InChIInChI=1S/C10H20OS/c1-5-8-10(3,4)7-9(11-8)12-6-2/h8-9H,5-7H2,1-4H3/t8-,9?/m1/s1
InChIKeyPZSOGZRSJMKJAN-VEDVMXKPSA-N
MW188.34 g/mol
LogP3.29
Rot. Bonds3

About (2R)-2-ethyl-5-ethylsulfanyl-3,3-dimethyloxolane

(2R)-2-ethyl-5-ethylsulfanyl-3,3-dimethyloxolane (PubChem CID 89397464) has the molecular formula C10H20OS and a molecular weight of 188.34 g/mol. Its IUPAC name is (2R)-2-ethyl-5-ethylsulfanyl-3,3-dimethyloxolane.

Molecular Properties

Compound Name(2R)-2-ethyl-5-ethylsulfanyl-3,3-dimethyloxolane
PubChem CID89397464
Molecular FormulaC10H20OS
Molecular Weight188.34 g/mol
Exact Mass188.12
IUPAC Name(2R)-2-ethyl-5-ethylsulfanyl-3,3-dimethyloxolane
SMILESCCSC1CC(C)(C)[C@@H](CC)O1
InChIInChI=1S/C10H20OS/c1-5-8-10(3,4)7-9(11-8)12-6-2/h8-9H,5-7H2,1-4H3/t8-,9?/m1/s1
InChIKeyPZSOGZRSJMKJAN-VEDVMXKPSA-N
XLogP3.29
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.34
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-ethyl-5-ethylsulfanyl-3,3-dimethyloxolane?
The IUPAC name of (2R)-2-ethyl-5-ethylsulfanyl-3,3-dimethyloxolane (CID 89397464) is (2R)-2-ethyl-5-ethylsulfanyl-3,3-dimethyloxolane.
What is the SMILES notation for (2R)-2-ethyl-5-ethylsulfanyl-3,3-dimethyloxolane?
The canonical SMILES for (2R)-2-ethyl-5-ethylsulfanyl-3,3-dimethyloxolane is CCSC1CC(C)(C)[C@@H](CC)O1.
What is the InChIKey of (2R)-2-ethyl-5-ethylsulfanyl-3,3-dimethyloxolane?
The InChIKey is PZSOGZRSJMKJAN-VEDVMXKPSA-N. The full InChI is InChI=1S/C10H20OS/c1-5-8-10(3,4)7-9(11-8)12-6-2/h8-9H,5-7H2,1-4H3/t8-,9?/m1/s1.
What are the key properties of (2R)-2-ethyl-5-ethylsulfanyl-3,3-dimethyloxolane?
(2R)-2-ethyl-5-ethylsulfanyl-3,3-dimethyloxolane has a molecular weight of 188.34 g/mol, XLogP of 3.29, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-ethyl-5-ethylsulfanyl-3,3-dimethyloxolane is sourced from PubChem (CID 89397464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).