2-[(2R,3R)-3-ethenyloxiran-2-yl]ethanol

C6H10O2 — CID 10057474

IUPAC2-[(2R,3R)-3-ethenyloxiran-2-yl]ethanol
SMILESC=C[C@H]1O[C@@H]1CCO
InChIInChI=1S/C6H10O2/c1-2-5-6(8-5)3-4-7/h2,5-7H,1,3-4H2/t5-,6-/m1/s1
InChIKeyODWVBZIOHSSNLF-PHDIDXHHSA-N
MW114.14 g/mol
LogP0.32
Rot. Bonds3

About 2-[(2R,3R)-3-ethenyloxiran-2-yl]ethanol

2-[(2R,3R)-3-ethenyloxiran-2-yl]ethanol (PubChem CID 10057474) has the molecular formula C6H10O2 and a molecular weight of 114.14 g/mol. Its IUPAC name is 2-[(2R,3R)-3-ethenyloxiran-2-yl]ethanol.

Molecular Properties

Compound Name2-[(2R,3R)-3-ethenyloxiran-2-yl]ethanol
PubChem CID10057474
Molecular FormulaC6H10O2
Molecular Weight114.14 g/mol
Exact Mass114.07
IUPAC Name2-[(2R,3R)-3-ethenyloxiran-2-yl]ethanol
SMILESC=C[C@H]1O[C@@H]1CCO
InChIInChI=1S/C6H10O2/c1-2-5-6(8-5)3-4-7/h2,5-7H,1,3-4H2/t5-,6-/m1/s1
InChIKeyODWVBZIOHSSNLF-PHDIDXHHSA-N
XLogP0.32
TPSA32.76 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.14
LogP ≤ 50.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-[(3R)-3-ethenyloxiran-2-yl]butan-1-ol
CID 87561862
(2S,3S)-2-ethenyl-3-ethyloxirane
CID 134927722
(2S,3R,4R,5R)-3,4-dihydroxy-5-(2-hydroxyethyl)oxolane-2-carbaldehyde
CID 101027471
2-[(2S,5R)-5-but-3-enyl-2,5-dihydrofuran-2-yl]ethanol
CID 89228344
(2S,3R,5S)-2-ethenyl-5-(hydroxymethyl)oxolan-3-ol
CID 130917823
N-[[[(2S,3R)-3-ethenyloxiran-2-yl]methylamino]methyl]hydroxylamine
CID 129016843
(2S,3R)-3-pent-4-enyloxirane-2-carbaldehyde
CID 23271404
(E)-3-[5-ethenyl-3,4-bis(hydroxymethyl)oxolan-2-yl]prop-2-en-1-ol
CID 59658485
2-ethenyl-3-tetradec-5-enyloxirane
CID 175141614
2-[(2S,3R)-3-ethyloxiran-2-yl]ethanol
CID 10290771
(3R,4S,5R)-5-(2-hydroxyethyl)oxolane-2,3,4-triol
CID 11829769
2-(hydroxymethyl)-6-prop-2-enyloxane-3,4,5-triol
CID 162127183

Frequently Asked Questions

What is the IUPAC name of 2-[(2R,3R)-3-ethenyloxiran-2-yl]ethanol?
The IUPAC name of 2-[(2R,3R)-3-ethenyloxiran-2-yl]ethanol (CID 10057474) is 2-[(2R,3R)-3-ethenyloxiran-2-yl]ethanol.
What is the SMILES notation for 2-[(2R,3R)-3-ethenyloxiran-2-yl]ethanol?
The canonical SMILES for 2-[(2R,3R)-3-ethenyloxiran-2-yl]ethanol is C=C[C@H]1O[C@@H]1CCO.
What is the InChIKey of 2-[(2R,3R)-3-ethenyloxiran-2-yl]ethanol?
The InChIKey is ODWVBZIOHSSNLF-PHDIDXHHSA-N. The full InChI is InChI=1S/C6H10O2/c1-2-5-6(8-5)3-4-7/h2,5-7H,1,3-4H2/t5-,6-/m1/s1.
What are the key properties of 2-[(2R,3R)-3-ethenyloxiran-2-yl]ethanol?
2-[(2R,3R)-3-ethenyloxiran-2-yl]ethanol has a molecular weight of 114.14 g/mol, XLogP of 0.32, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R,3R)-3-ethenyloxiran-2-yl]ethanol is sourced from PubChem (CID 10057474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).