6-ethoxy-3-(2-hydroxyethyl)-5-methyloxane-3,4-diol

C10H20O5 — CID 91186946

IUPAC6-ethoxy-3-(2-hydroxyethyl)-5-methyloxane-3,4-diol
SMILESCCOC1OCC(O)(CCO)C(O)C1C
InChIInChI=1S/C10H20O5/c1-3-14-9-7(2)8(12)10(13,4-5-11)6-15-9/h7-9,11-13H,3-6H2,1-2H3
InChIKeyWMARGIWSRKDORJ-UHFFFAOYSA-N
MW220.26 g/mol
LogP-0.51
Rot. Bonds4

About 6-ethoxy-3-(2-hydroxyethyl)-5-methyloxane-3,4-diol

6-ethoxy-3-(2-hydroxyethyl)-5-methyloxane-3,4-diol (PubChem CID 91186946) has the molecular formula C10H20O5 and a molecular weight of 220.26 g/mol. Its IUPAC name is 6-ethoxy-3-(2-hydroxyethyl)-5-methyloxane-3,4-diol.

Molecular Properties

Compound Name6-ethoxy-3-(2-hydroxyethyl)-5-methyloxane-3,4-diol
PubChem CID91186946
Molecular FormulaC10H20O5
Molecular Weight220.26 g/mol
Exact Mass220.13
IUPAC Name6-ethoxy-3-(2-hydroxyethyl)-5-methyloxane-3,4-diol
SMILESCCOC1OCC(O)(CCO)C(O)C1C
InChIInChI=1S/C10H20O5/c1-3-14-9-7(2)8(12)10(13,4-5-11)6-15-9/h7-9,11-13H,3-6H2,1-2H3
InChIKeyWMARGIWSRKDORJ-UHFFFAOYSA-N
XLogP-0.51
TPSA79.15 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.26
LogP ≤ 5-0.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-3-(2-hydroxyethyl)-5-methyloxane-3,4-diol?
The IUPAC name of 6-ethoxy-3-(2-hydroxyethyl)-5-methyloxane-3,4-diol (CID 91186946) is 6-ethoxy-3-(2-hydroxyethyl)-5-methyloxane-3,4-diol.
What is the SMILES notation for 6-ethoxy-3-(2-hydroxyethyl)-5-methyloxane-3,4-diol?
The canonical SMILES for 6-ethoxy-3-(2-hydroxyethyl)-5-methyloxane-3,4-diol is CCOC1OCC(O)(CCO)C(O)C1C.
What is the InChIKey of 6-ethoxy-3-(2-hydroxyethyl)-5-methyloxane-3,4-diol?
The InChIKey is WMARGIWSRKDORJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O5/c1-3-14-9-7(2)8(12)10(13,4-5-11)6-15-9/h7-9,11-13H,3-6H2,1-2H3.
What are the key properties of 6-ethoxy-3-(2-hydroxyethyl)-5-methyloxane-3,4-diol?
6-ethoxy-3-(2-hydroxyethyl)-5-methyloxane-3,4-diol has a molecular weight of 220.26 g/mol, XLogP of -0.51, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-3-(2-hydroxyethyl)-5-methyloxane-3,4-diol is sourced from PubChem (CID 91186946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).