[(1R)-1-[(2R)-oxolan-2-yl]ethyl] acetate

C8H14O3 — CID 14358346

IUPAC[(1R)-1-[(2R)-oxolan-2-yl]ethyl] acetate
SMILESCC(=O)O[C@H](C)[C@H]1CCCO1
InChIInChI=1S/C8H14O3/c1-6(11-7(2)9)8-4-3-5-10-8/h6,8H,3-5H2,1-2H3/t6-,8-/m1/s1
InChIKeyTWUYHQWVWDHHIY-HTRCEHHLSA-N
MW158.20 g/mol
LogP1.12
Rot. Bonds2

About [(1R)-1-[(2R)-oxolan-2-yl]ethyl] acetate

[(1R)-1-[(2R)-oxolan-2-yl]ethyl] acetate (PubChem CID 14358346) has the molecular formula C8H14O3 and a molecular weight of 158.20 g/mol. Its IUPAC name is [(1R)-1-[(2R)-oxolan-2-yl]ethyl] acetate.

Molecular Properties

Compound Name[(1R)-1-[(2R)-oxolan-2-yl]ethyl] acetate
PubChem CID14358346
Molecular FormulaC8H14O3
Molecular Weight158.20 g/mol
Exact Mass158.09
IUPAC Name[(1R)-1-[(2R)-oxolan-2-yl]ethyl] acetate
SMILESCC(=O)O[C@H](C)[C@H]1CCCO1
InChIInChI=1S/C8H14O3/c1-6(11-7(2)9)8-4-3-5-10-8/h6,8H,3-5H2,1-2H3/t6-,8-/m1/s1
InChIKeyTWUYHQWVWDHHIY-HTRCEHHLSA-N
XLogP1.12
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 51.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [(1R)-1-[(2R)-oxolan-2-yl]ethyl] acetate?
The IUPAC name of [(1R)-1-[(2R)-oxolan-2-yl]ethyl] acetate (CID 14358346) is [(1R)-1-[(2R)-oxolan-2-yl]ethyl] acetate.
What is the SMILES notation for [(1R)-1-[(2R)-oxolan-2-yl]ethyl] acetate?
The canonical SMILES for [(1R)-1-[(2R)-oxolan-2-yl]ethyl] acetate is CC(=O)O[C@H](C)[C@H]1CCCO1.
What is the InChIKey of [(1R)-1-[(2R)-oxolan-2-yl]ethyl] acetate?
The InChIKey is TWUYHQWVWDHHIY-HTRCEHHLSA-N. The full InChI is InChI=1S/C8H14O3/c1-6(11-7(2)9)8-4-3-5-10-8/h6,8H,3-5H2,1-2H3/t6-,8-/m1/s1.
What are the key properties of [(1R)-1-[(2R)-oxolan-2-yl]ethyl] acetate?
[(1R)-1-[(2R)-oxolan-2-yl]ethyl] acetate has a molecular weight of 158.20 g/mol, XLogP of 1.12, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R)-1-[(2R)-oxolan-2-yl]ethyl] acetate is sourced from PubChem (CID 14358346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).