[(2S)-2-ethenyloxiran-2-yl]methanol

C5H8O2 — CID 131089361

IUPAC[(2S)-2-ethenyloxiran-2-yl]methanol
SMILESC=C[C@]1(CO)CO1
InChIInChI=1S/C5H8O2/c1-2-5(3-6)4-7-5/h2,6H,1,3-4H2/t5-/m0/s1
InChIKeyAPUGKZYIPQVHGT-YFKPBYRVSA-N
MW100.12 g/mol
LogP-0.07
Rot. Bonds2

About [(2S)-2-ethenyloxiran-2-yl]methanol

[(2S)-2-ethenyloxiran-2-yl]methanol (PubChem CID 131089361) has the molecular formula C5H8O2 and a molecular weight of 100.12 g/mol. Its IUPAC name is [(2S)-2-ethenyloxiran-2-yl]methanol.

Molecular Properties

Compound Name[(2S)-2-ethenyloxiran-2-yl]methanol
PubChem CID131089361
Molecular FormulaC5H8O2
Molecular Weight100.12 g/mol
Exact Mass100.05
IUPAC Name[(2S)-2-ethenyloxiran-2-yl]methanol
SMILESC=C[C@]1(CO)CO1
InChIInChI=1S/C5H8O2/c1-2-5(3-6)4-7-5/h2,6H,1,3-4H2/t5-/m0/s1
InChIKeyAPUGKZYIPQVHGT-YFKPBYRVSA-N
XLogP-0.07
TPSA32.76 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.12
LogP ≤ 5-0.07
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

(2R)-2-methoxy-2-methylbut-3-en-1-ol
CID 29924164
[(2S)-2-ethenyl-1,4-dioxan-2-yl]methanol
CID 162409992
2-Methoxy-2-methylbut-3-EN-1-OL
CID 20448587
2-(Oxiran-2-ylmethoxy)but-3-en-1-ol
CID 22465181
[(2S)-2-[(E)-prop-1-enyl]oxiran-2-yl]methanol
CID 25260360
(2-Prop-1-enyloxiran-2-yl)methanol
CID 74437439
2-Ethenyl-2-[3-(hydroxymethyl)penta-1,4-dien-3-yloxy]but-3-en-1-ol
CID 87835530
(2-Ethenyloxiran-2-yl)methanol
CID 130144913
[(2R)-2-ethenyloxiran-2-yl]methanol
CID 140423810
[(2R)-2-[(E)-prop-1-enyl]oxiran-2-yl]methanol
CID 141065422
2-Ethenyl-2-methyloxirane;2-methylbut-3-ene-1,2-diol
CID 157265227
[(2R)-2-(1-ethoxyethenyl)oxiran-2-yl]methanol
CID 165390019

Frequently Asked Questions

What is the IUPAC name of [(2S)-2-ethenyloxiran-2-yl]methanol?
The IUPAC name of [(2S)-2-ethenyloxiran-2-yl]methanol (CID 131089361) is [(2S)-2-ethenyloxiran-2-yl]methanol.
What is the SMILES notation for [(2S)-2-ethenyloxiran-2-yl]methanol?
The canonical SMILES for [(2S)-2-ethenyloxiran-2-yl]methanol is C=C[C@]1(CO)CO1.
What is the InChIKey of [(2S)-2-ethenyloxiran-2-yl]methanol?
The InChIKey is APUGKZYIPQVHGT-YFKPBYRVSA-N. The full InChI is InChI=1S/C5H8O2/c1-2-5(3-6)4-7-5/h2,6H,1,3-4H2/t5-/m0/s1.
What are the key properties of [(2S)-2-ethenyloxiran-2-yl]methanol?
[(2S)-2-ethenyloxiran-2-yl]methanol has a molecular weight of 100.12 g/mol, XLogP of -0.07, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S)-2-ethenyloxiran-2-yl]methanol is sourced from PubChem (CID 131089361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).