ethyl (2R)-2-acetyloxy-2-[(2R)-oxolan-2-yl]acetate

C10H16O5 — CID 11241385

IUPACethyl (2R)-2-acetyloxy-2-[(2R)-oxolan-2-yl]acetate
SMILESCCOC(=O)[C@H](OC(C)=O)[C@H]1CCCO1
InChIInChI=1S/C10H16O5/c1-3-13-10(12)9(15-7(2)11)8-5-4-6-14-8/h8-9H,3-6H2,1-2H3/t8-,9-/m1/s1
InChIKeyNJDUYEZFWQXSNU-RKDXNWHRSA-N
MW216.23 g/mol
LogP0.66
Rot. Bonds4

About ethyl (2R)-2-acetyloxy-2-[(2R)-oxolan-2-yl]acetate

ethyl (2R)-2-acetyloxy-2-[(2R)-oxolan-2-yl]acetate (PubChem CID 11241385) has the molecular formula C10H16O5 and a molecular weight of 216.23 g/mol. Its IUPAC name is ethyl (2R)-2-acetyloxy-2-[(2R)-oxolan-2-yl]acetate.

Molecular Properties

Compound Nameethyl (2R)-2-acetyloxy-2-[(2R)-oxolan-2-yl]acetate
PubChem CID11241385
Molecular FormulaC10H16O5
Molecular Weight216.23 g/mol
Exact Mass216.10
IUPAC Nameethyl (2R)-2-acetyloxy-2-[(2R)-oxolan-2-yl]acetate
SMILESCCOC(=O)[C@H](OC(C)=O)[C@H]1CCCO1
InChIInChI=1S/C10H16O5/c1-3-13-10(12)9(15-7(2)11)8-5-4-6-14-8/h8-9H,3-6H2,1-2H3/t8-,9-/m1/s1
InChIKeyNJDUYEZFWQXSNU-RKDXNWHRSA-N
XLogP0.66
TPSA61.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.23
LogP ≤ 50.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 3-oxo-2-(oxolan-2-yl)butanoate
CID 14416095
ethyl 2-[hydroxy(oxolan-2-yl)methyl]butanoate
CID 82837689
[(1R)-1-[(2R)-oxolan-2-yl]ethyl] acetate
CID 14358346
[2-hydroxy-1-(oxolan-2-yl)ethyl] acetate
CID 121404223
ethyl 3-hydroxy-3-(oxolan-2-yl)propanoate
CID 82837463
ethyl 2-oxo-2-[1-(oxolan-2-yl)ethylamino]acetate
CID 60895927
ethyl 3-(ethylamino)-3-(oxolan-2-yl)propanoate
CID 82837469
ethyl (2R)-4-oxo-2-[[(2S)-oxolan-2-yl]methyl]butanoate
CID 135077669
ethyl 2-hydroxy-3-(oxolan-2-yl)propanoate
CID 11788721
[ethoxy(oxolan-2-yl)methyl] prop-2-enoate
CID 175540639
[(1S)-1-[(2S)-oxan-2-yl]prop-2-ynyl] acetate
CID 10797506
ethyl 3-methyl-2-(oxolane-2-carbonyl)butanoate
CID 65328489

Frequently Asked Questions

What is the IUPAC name of ethyl (2R)-2-acetyloxy-2-[(2R)-oxolan-2-yl]acetate?
The IUPAC name of ethyl (2R)-2-acetyloxy-2-[(2R)-oxolan-2-yl]acetate (CID 11241385) is ethyl (2R)-2-acetyloxy-2-[(2R)-oxolan-2-yl]acetate.
What is the SMILES notation for ethyl (2R)-2-acetyloxy-2-[(2R)-oxolan-2-yl]acetate?
The canonical SMILES for ethyl (2R)-2-acetyloxy-2-[(2R)-oxolan-2-yl]acetate is CCOC(=O)[C@H](OC(C)=O)[C@H]1CCCO1.
What is the InChIKey of ethyl (2R)-2-acetyloxy-2-[(2R)-oxolan-2-yl]acetate?
The InChIKey is NJDUYEZFWQXSNU-RKDXNWHRSA-N. The full InChI is InChI=1S/C10H16O5/c1-3-13-10(12)9(15-7(2)11)8-5-4-6-14-8/h8-9H,3-6H2,1-2H3/t8-,9-/m1/s1.
What are the key properties of ethyl (2R)-2-acetyloxy-2-[(2R)-oxolan-2-yl]acetate?
ethyl (2R)-2-acetyloxy-2-[(2R)-oxolan-2-yl]acetate has a molecular weight of 216.23 g/mol, XLogP of 0.66, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl (2R)-2-acetyloxy-2-[(2R)-oxolan-2-yl]acetate is sourced from PubChem (CID 11241385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).