(2R,3S)-2,3-diethoxyoxirane

C6H12O3 — CID 10701862

IUPAC(2R,3S)-2,3-diethoxyoxirane
SMILESCCO[C@@H]1O[C@@H]1OCC
InChIInChI=1S/C6H12O3/c1-3-7-5-6(9-5)8-4-2/h5-6H,3-4H2,1-2H3/t5-,6+
InChIKeyAMTTVTLMJJQDRN-OLQVQODUSA-N
MW132.16 g/mol
LogP0.74
Rot. Bonds4

About (2R,3S)-2,3-diethoxyoxirane

(2R,3S)-2,3-diethoxyoxirane (PubChem CID 10701862) has the molecular formula C6H12O3 and a molecular weight of 132.16 g/mol. Its IUPAC name is (2R,3S)-2,3-diethoxyoxirane.

Molecular Properties

Compound Name(2R,3S)-2,3-diethoxyoxirane
PubChem CID10701862
Molecular FormulaC6H12O3
Molecular Weight132.16 g/mol
Exact Mass132.08
IUPAC Name(2R,3S)-2,3-diethoxyoxirane
SMILESCCO[C@@H]1O[C@@H]1OCC
InChIInChI=1S/C6H12O3/c1-3-7-5-6(9-5)8-4-2/h5-6H,3-4H2,1-2H3/t5-,6+
InChIKeyAMTTVTLMJJQDRN-OLQVQODUSA-N
XLogP0.74
TPSA30.99 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.16
LogP ≤ 50.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Related Compounds

3,4-diethoxydioxetane
CID 59986645
(2S,3R,5S,6S)-2,3,5,6-tetraethoxy-4-methyloxane
CID 162134537
2-(4,5-diethoxy-1,3-dioxolan-2-yl)-1,3-dioxolane-4,5-diol
CID 86153336
3-ethoxy-N-methyloxiran-2-amine
CID 154561397
2-ethoxy-3-[7-[[3,8,9-tris[7-(3-ethoxyoxiran-2-yl)oxyheptoxy]-2-tetracyclo[5.5.2.04,13.010,14]tetradeca-1(13),4,6,10(14),11-pentaenyl]oxy]heptoxy]oxirane
CID 137441056
6-ethoxy-2,5-dimethyloxane-3,4-diol
CID 159419325
(2R,3R,4R,5R)-2-ethoxy-5-(hydroxymethyl)oxolane-3,4-diol
CID 14353032
(2S,5S)-2-ethoxy-6-ethyloxane-3,4,5-triol
CID 167273619
2-ethoxy-5-(hydroxymethyl)oxolane-3,4-diol
CID 548249
(1R,2R,5R)-2-but-3-enyl-4-ethoxy-3,6-dioxabicyclo[3.1.0]hexane
CID 10261797
2-ethoxy-3-[(3-methylthiiran-2-yl)methyl]oxirane
CID 123854628
(2R,5R)-2-ethoxy-6-(hydroxymethyl)oxane-3,4,5-triol
CID 121419897

Frequently Asked Questions

What is the IUPAC name of (2R,3S)-2,3-diethoxyoxirane?
The IUPAC name of (2R,3S)-2,3-diethoxyoxirane (CID 10701862) is (2R,3S)-2,3-diethoxyoxirane.
What is the SMILES notation for (2R,3S)-2,3-diethoxyoxirane?
The canonical SMILES for (2R,3S)-2,3-diethoxyoxirane is CCO[C@@H]1O[C@@H]1OCC.
What is the InChIKey of (2R,3S)-2,3-diethoxyoxirane?
The InChIKey is AMTTVTLMJJQDRN-OLQVQODUSA-N. The full InChI is InChI=1S/C6H12O3/c1-3-7-5-6(9-5)8-4-2/h5-6H,3-4H2,1-2H3/t5-,6+.
What are the key properties of (2R,3S)-2,3-diethoxyoxirane?
(2R,3S)-2,3-diethoxyoxirane has a molecular weight of 132.16 g/mol, XLogP of 0.74, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3S)-2,3-diethoxyoxirane is sourced from PubChem (CID 10701862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).