5-ethyl-4-methyloxolane-2,3-diol

C7H14O3 — CID 21338247

IUPAC5-ethyl-4-methyloxolane-2,3-diol
SMILESCCC1OC(O)C(O)C1C
InChIInChI=1S/C7H14O3/c1-3-5-4(2)6(8)7(9)10-5/h4-9H,3H2,1-2H3
InChIKeyWNUWDHOWKZHDQF-UHFFFAOYSA-N
MW146.19 g/mol
LogP0.11
Rot. Bonds1

About 5-ethyl-4-methyloxolane-2,3-diol

5-ethyl-4-methyloxolane-2,3-diol (PubChem CID 21338247) has the molecular formula C7H14O3 and a molecular weight of 146.19 g/mol. Its IUPAC name is 5-ethyl-4-methyloxolane-2,3-diol.

Molecular Properties

Compound Name5-ethyl-4-methyloxolane-2,3-diol
PubChem CID21338247
Molecular FormulaC7H14O3
Molecular Weight146.19 g/mol
Exact Mass146.09
IUPAC Name5-ethyl-4-methyloxolane-2,3-diol
SMILESCCC1OC(O)C(O)C1C
InChIInChI=1S/C7H14O3/c1-3-5-4(2)6(8)7(9)10-5/h4-9H,3H2,1-2H3
InChIKeyWNUWDHOWKZHDQF-UHFFFAOYSA-N
XLogP0.11
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 50.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(4S,5S)-6-ethyl-4-methyloxane-2,3,5-triol
CID 90429062
(2S,3R,5S)-5-ethyl-3,4-dimethyloxolan-2-ol
CID 59063589
actinium;(2S,3R,5S)-5-ethyl-3,4-dimethyloxolan-2-ol
CID 59063588
(3R,4S,5R)-5-ethyloxolane-2,3,4-triol
CID 59169178
(3R,5S)-6-ethyl-2,5-dimethyloxane-3,4-diol
CID 142172464
(2S,4S,5R)-6-ethyl-2,5-dimethyloxane-3,4-diol
CID 59046301
(2R,5S)-6-ethyloxane-2,3,4,5-tetrol
CID 163614233
(2R,6S)-6-ethyloxane-2,3,4,5-tetrol
CID 138718011
(2S,3R,4S,5S,6R)-6-ethyloxane-2,3,4,5-tetrol
CID 58340219
(6R)-6-ethyloxane-2,3,4,5-tetrol
CID 59974126
CID 58870598
CID 58870598
(2S,3R,5S)-6-(hydroxymethyl)-4-methyloxane-2,3,5-triol
CID 148775123

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-4-methyloxolane-2,3-diol?
The IUPAC name of 5-ethyl-4-methyloxolane-2,3-diol (CID 21338247) is 5-ethyl-4-methyloxolane-2,3-diol.
What is the SMILES notation for 5-ethyl-4-methyloxolane-2,3-diol?
The canonical SMILES for 5-ethyl-4-methyloxolane-2,3-diol is CCC1OC(O)C(O)C1C.
What is the InChIKey of 5-ethyl-4-methyloxolane-2,3-diol?
The InChIKey is WNUWDHOWKZHDQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14O3/c1-3-5-4(2)6(8)7(9)10-5/h4-9H,3H2,1-2H3.
What are the key properties of 5-ethyl-4-methyloxolane-2,3-diol?
5-ethyl-4-methyloxolane-2,3-diol has a molecular weight of 146.19 g/mol, XLogP of 0.11, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-4-methyloxolane-2,3-diol is sourced from PubChem (CID 21338247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).