(2S,3R)-2-prop-2-enyloxan-3-ol

C8H14O2 — CID 14917728

IUPAC(2S,3R)-2-prop-2-enyloxan-3-ol
SMILESC=CC[C@@H]1OCCC[C@H]1O
InChIInChI=1S/C8H14O2/c1-2-4-8-7(9)5-3-6-10-8/h2,7-9H,1,3-6H2/t7-,8+/m1/s1
InChIKeyBTKDCGCMIXPGNH-SFYZADRCSA-N
MW142.20 g/mol
LogP1.10
Rot. Bonds2

About (2S,3R)-2-prop-2-enyloxan-3-ol

(2S,3R)-2-prop-2-enyloxan-3-ol (PubChem CID 14917728) has the molecular formula C8H14O2 and a molecular weight of 142.20 g/mol. Its IUPAC name is (2S,3R)-2-prop-2-enyloxan-3-ol.

Molecular Properties

Compound Name(2S,3R)-2-prop-2-enyloxan-3-ol
PubChem CID14917728
Molecular FormulaC8H14O2
Molecular Weight142.20 g/mol
Exact Mass142.10
IUPAC Name(2S,3R)-2-prop-2-enyloxan-3-ol
SMILESC=CC[C@@H]1OCCC[C@H]1O
InChIInChI=1S/C8H14O2/c1-2-4-8-7(9)5-3-6-10-8/h2,7-9H,1,3-6H2/t7-,8+/m1/s1
InChIKeyBTKDCGCMIXPGNH-SFYZADRCSA-N
XLogP1.10
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(2S,3R)-2-ethyloxan-3-ol
CID 101188955
(2R,3S)-3-penta-1,4-dien-3-yloxy-2-prop-2-enyloxane
CID 132969009
(2S,3S)-2-prop-2-enoxyoxan-3-ol
CID 130770210
3-chloro-2-prop-2-enyloxolane
CID 13494562
3-tert-butyl-2-prop-2-enyloxolane
CID 15502844
(2-prop-2-enyloxan-3-yl) butanoate
CID 15372487
(2R,3S)-3-pent-4-enoxy-2-prop-2-enyloxane
CID 10608531
(2R,3R)-2-[[(2S,3S)-3-(hydroxymethyl)oxiran-2-yl]methyl]oxan-3-ol
CID 100946621
(Z,4R)-5-[(2R,3S)-3-hydroxyoxan-2-yl]pent-2-ene-1,4-diol
CID 135029005
(1R,2R,3R)-2-prop-2-enyl-3-trimethylsilylcyclohexan-1-ol
CID 10998343
3-methyl-2-prop-2-enylcyclohexan-1-ol
CID 71440529
(1S,3R,4R,5R)-4-ethenyl-5-(oxolan-2-ylmethyl)cyclopentane-1,3-diol
CID 167554569

Frequently Asked Questions

What is the IUPAC name of (2S,3R)-2-prop-2-enyloxan-3-ol?
The IUPAC name of (2S,3R)-2-prop-2-enyloxan-3-ol (CID 14917728) is (2S,3R)-2-prop-2-enyloxan-3-ol.
What is the SMILES notation for (2S,3R)-2-prop-2-enyloxan-3-ol?
The canonical SMILES for (2S,3R)-2-prop-2-enyloxan-3-ol is C=CC[C@@H]1OCCC[C@H]1O.
What is the InChIKey of (2S,3R)-2-prop-2-enyloxan-3-ol?
The InChIKey is BTKDCGCMIXPGNH-SFYZADRCSA-N. The full InChI is InChI=1S/C8H14O2/c1-2-4-8-7(9)5-3-6-10-8/h2,7-9H,1,3-6H2/t7-,8+/m1/s1.
What are the key properties of (2S,3R)-2-prop-2-enyloxan-3-ol?
(2S,3R)-2-prop-2-enyloxan-3-ol has a molecular weight of 142.20 g/mol, XLogP of 1.10, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,3R)-2-prop-2-enyloxan-3-ol is sourced from PubChem (CID 14917728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).