2-[(2R)-3-hexoxyoxolan-2-yl]ethanol

C12H24O3 — CID 145103841

IUPAC2-[(2R)-3-hexoxyoxolan-2-yl]ethanol
SMILESCCCCCCOC1CCO[C@@H]1CCO
InChIInChI=1S/C12H24O3/c1-2-3-4-5-9-14-12-7-10-15-11(12)6-8-13/h11-13H,2-10H2,1H3/t11-,12?/m1/s1
InChIKeyFFCZFNQHOHGNBI-JHJMLUEUSA-N
MW216.32 g/mol
LogP2.12
Rot. Bonds8

About 2-[(2R)-3-hexoxyoxolan-2-yl]ethanol

2-[(2R)-3-hexoxyoxolan-2-yl]ethanol (PubChem CID 145103841) has the molecular formula C12H24O3 and a molecular weight of 216.32 g/mol. Its IUPAC name is 2-[(2R)-3-hexoxyoxolan-2-yl]ethanol.

Molecular Properties

Compound Name2-[(2R)-3-hexoxyoxolan-2-yl]ethanol
PubChem CID145103841
Molecular FormulaC12H24O3
Molecular Weight216.32 g/mol
Exact Mass216.17
IUPAC Name2-[(2R)-3-hexoxyoxolan-2-yl]ethanol
SMILESCCCCCCOC1CCO[C@@H]1CCO
InChIInChI=1S/C12H24O3/c1-2-3-4-5-9-14-12-7-10-15-11(12)6-8-13/h11-13H,2-10H2,1H3/t11-,12?/m1/s1
InChIKeyFFCZFNQHOHGNBI-JHJMLUEUSA-N
XLogP2.12
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[(2R)-3-hexoxyoxolan-2-yl]ethanol?
The IUPAC name of 2-[(2R)-3-hexoxyoxolan-2-yl]ethanol (CID 145103841) is 2-[(2R)-3-hexoxyoxolan-2-yl]ethanol.
What is the SMILES notation for 2-[(2R)-3-hexoxyoxolan-2-yl]ethanol?
The canonical SMILES for 2-[(2R)-3-hexoxyoxolan-2-yl]ethanol is CCCCCCOC1CCO[C@@H]1CCO.
What is the InChIKey of 2-[(2R)-3-hexoxyoxolan-2-yl]ethanol?
The InChIKey is FFCZFNQHOHGNBI-JHJMLUEUSA-N. The full InChI is InChI=1S/C12H24O3/c1-2-3-4-5-9-14-12-7-10-15-11(12)6-8-13/h11-13H,2-10H2,1H3/t11-,12?/m1/s1.
What are the key properties of 2-[(2R)-3-hexoxyoxolan-2-yl]ethanol?
2-[(2R)-3-hexoxyoxolan-2-yl]ethanol has a molecular weight of 216.32 g/mol, XLogP of 2.12, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R)-3-hexoxyoxolan-2-yl]ethanol is sourced from PubChem (CID 145103841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).