2-ethenyl-3-prop-2-enoxypent-4-ene-1,2-diol

C10H16O3 — CID 141448219

IUPAC2-ethenyl-3-prop-2-enoxypent-4-ene-1,2-diol
SMILESC=CCOC(C=C)C(O)(C=C)CO
InChIInChI=1S/C10H16O3/c1-4-7-13-9(5-2)10(12,6-3)8-11/h4-6,9,11-12H,1-3,7-8H2
InChIKeyHQHRRNLYTBGYFP-UHFFFAOYSA-N
MW184.23 g/mol
LogP0.65
Rot. Bonds7

About 2-ethenyl-3-prop-2-enoxypent-4-ene-1,2-diol

2-ethenyl-3-prop-2-enoxypent-4-ene-1,2-diol (PubChem CID 141448219) has the molecular formula C10H16O3 and a molecular weight of 184.23 g/mol. Its IUPAC name is 2-ethenyl-3-prop-2-enoxypent-4-ene-1,2-diol.

Molecular Properties

Compound Name2-ethenyl-3-prop-2-enoxypent-4-ene-1,2-diol
PubChem CID141448219
Molecular FormulaC10H16O3
Molecular Weight184.23 g/mol
Exact Mass184.11
IUPAC Name2-ethenyl-3-prop-2-enoxypent-4-ene-1,2-diol
SMILESC=CCOC(C=C)C(O)(C=C)CO
InChIInChI=1S/C10H16O3/c1-4-7-13-9(5-2)10(12,6-3)8-11/h4-6,9,11-12H,1-3,7-8H2
InChIKeyHQHRRNLYTBGYFP-UHFFFAOYSA-N
XLogP0.65
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.23
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-3-prop-2-enoxypent-4-ene-1,2-diol?
The IUPAC name of 2-ethenyl-3-prop-2-enoxypent-4-ene-1,2-diol (CID 141448219) is 2-ethenyl-3-prop-2-enoxypent-4-ene-1,2-diol.
What is the SMILES notation for 2-ethenyl-3-prop-2-enoxypent-4-ene-1,2-diol?
The canonical SMILES for 2-ethenyl-3-prop-2-enoxypent-4-ene-1,2-diol is C=CCOC(C=C)C(O)(C=C)CO.
What is the InChIKey of 2-ethenyl-3-prop-2-enoxypent-4-ene-1,2-diol?
The InChIKey is HQHRRNLYTBGYFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O3/c1-4-7-13-9(5-2)10(12,6-3)8-11/h4-6,9,11-12H,1-3,7-8H2.
What are the key properties of 2-ethenyl-3-prop-2-enoxypent-4-ene-1,2-diol?
2-ethenyl-3-prop-2-enoxypent-4-ene-1,2-diol has a molecular weight of 184.23 g/mol, XLogP of 0.65, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-3-prop-2-enoxypent-4-ene-1,2-diol is sourced from PubChem (CID 141448219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).