[2,5-bis(ethenyl)-4-(hydroxymethyl)oxolan-3-yl]methanol

C10H16O3 — CID 59658486

IUPAC[2,5-bis(ethenyl)-4-(hydroxymethyl)oxolan-3-yl]methanol
SMILESC=CC1OC(C=C)C(CO)C1CO
InChIInChI=1S/C10H16O3/c1-3-9-7(5-11)8(6-12)10(4-2)13-9/h3-4,7-12H,1-2,5-6H2
InChIKeyGEZHPDDCKWHIFZ-UHFFFAOYSA-N
MW184.23 g/mol
LogP0.34
Rot. Bonds4

About [2,5-bis(ethenyl)-4-(hydroxymethyl)oxolan-3-yl]methanol

[2,5-bis(ethenyl)-4-(hydroxymethyl)oxolan-3-yl]methanol (PubChem CID 59658486) has the molecular formula C10H16O3 and a molecular weight of 184.23 g/mol. Its IUPAC name is [2,5-bis(ethenyl)-4-(hydroxymethyl)oxolan-3-yl]methanol.

Molecular Properties

Compound Name[2,5-bis(ethenyl)-4-(hydroxymethyl)oxolan-3-yl]methanol
PubChem CID59658486
Molecular FormulaC10H16O3
Molecular Weight184.23 g/mol
Exact Mass184.11
IUPAC Name[2,5-bis(ethenyl)-4-(hydroxymethyl)oxolan-3-yl]methanol
SMILESC=CC1OC(C=C)C(CO)C1CO
InChIInChI=1S/C10H16O3/c1-3-9-7(5-11)8(6-12)10(4-2)13-9/h3-4,7-12H,1-2,5-6H2
InChIKeyGEZHPDDCKWHIFZ-UHFFFAOYSA-N
XLogP0.34
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.23
LogP ≤ 50.34
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 [2,5-bis(ethenyl)-4-(hydroxymethyl)oxolan-3-yl]methanol?
The IUPAC name of [2,5-bis(ethenyl)-4-(hydroxymethyl)oxolan-3-yl]methanol (CID 59658486) is [2,5-bis(ethenyl)-4-(hydroxymethyl)oxolan-3-yl]methanol.
What is the SMILES notation for [2,5-bis(ethenyl)-4-(hydroxymethyl)oxolan-3-yl]methanol?
The canonical SMILES for [2,5-bis(ethenyl)-4-(hydroxymethyl)oxolan-3-yl]methanol is C=CC1OC(C=C)C(CO)C1CO.
What is the InChIKey of [2,5-bis(ethenyl)-4-(hydroxymethyl)oxolan-3-yl]methanol?
The InChIKey is GEZHPDDCKWHIFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O3/c1-3-9-7(5-11)8(6-12)10(4-2)13-9/h3-4,7-12H,1-2,5-6H2.
What are the key properties of [2,5-bis(ethenyl)-4-(hydroxymethyl)oxolan-3-yl]methanol?
[2,5-bis(ethenyl)-4-(hydroxymethyl)oxolan-3-yl]methanol has a molecular weight of 184.23 g/mol, XLogP of 0.34, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2,5-bis(ethenyl)-4-(hydroxymethyl)oxolan-3-yl]methanol is sourced from PubChem (CID 59658486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).