ethoxyethane;(5R)-5-(hydroxymethyl)oxolan-2-one

C9H18O4 — CID 69070711

IUPACethoxyethane;(5R)-5-(hydroxymethyl)oxolan-2-one
SMILESCCOCC.O=C1CC[C@H](CO)O1
InChIInChI=1S/C5H8O3.C4H10O/c6-3-4-1-2-5(7)8-4;1-3-5-4-2/h4,6H,1-3H2;3-4H2,1-2H3/t4-;/m1./s1
InChIKeySSWOLWGLEPDGTC-PGMHMLKASA-N
MW190.24 g/mol
LogP0.73
Rot. Bonds3

About ethoxyethane;(5R)-5-(hydroxymethyl)oxolan-2-one

ethoxyethane;(5R)-5-(hydroxymethyl)oxolan-2-one (PubChem CID 69070711) has the molecular formula C9H18O4 and a molecular weight of 190.24 g/mol. Its IUPAC name is ethoxyethane;(5R)-5-(hydroxymethyl)oxolan-2-one.

Molecular Properties

Compound Nameethoxyethane;(5R)-5-(hydroxymethyl)oxolan-2-one
PubChem CID69070711
Molecular FormulaC9H18O4
Molecular Weight190.24 g/mol
Exact Mass190.12
IUPAC Nameethoxyethane;(5R)-5-(hydroxymethyl)oxolan-2-one
SMILESCCOCC.O=C1CC[C@H](CO)O1
InChIInChI=1S/C5H8O3.C4H10O/c6-3-4-1-2-5(7)8-4;1-3-5-4-2/h4,6H,1-3H2;3-4H2,1-2H3/t4-;/m1./s1
InChIKeySSWOLWGLEPDGTC-PGMHMLKASA-N
XLogP0.73
TPSA55.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.24
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of ethoxyethane;(5R)-5-(hydroxymethyl)oxolan-2-one?
The IUPAC name of ethoxyethane;(5R)-5-(hydroxymethyl)oxolan-2-one (CID 69070711) is ethoxyethane;(5R)-5-(hydroxymethyl)oxolan-2-one.
What is the SMILES notation for ethoxyethane;(5R)-5-(hydroxymethyl)oxolan-2-one?
The canonical SMILES for ethoxyethane;(5R)-5-(hydroxymethyl)oxolan-2-one is CCOCC.O=C1CC[C@H](CO)O1.
What is the InChIKey of ethoxyethane;(5R)-5-(hydroxymethyl)oxolan-2-one?
The InChIKey is SSWOLWGLEPDGTC-PGMHMLKASA-N. The full InChI is InChI=1S/C5H8O3.C4H10O/c6-3-4-1-2-5(7)8-4;1-3-5-4-2/h4,6H,1-3H2;3-4H2,1-2H3/t4-;/m1./s1.
What are the key properties of ethoxyethane;(5R)-5-(hydroxymethyl)oxolan-2-one?
ethoxyethane;(5R)-5-(hydroxymethyl)oxolan-2-one has a molecular weight of 190.24 g/mol, XLogP of 0.73, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxyethane;(5R)-5-(hydroxymethyl)oxolan-2-one is sourced from PubChem (CID 69070711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).