(Z)-5-(1,3-dioxolan-2-yl)pent-2-en-1-ol

C8H14O3 — CID 68873060

IUPAC(Z)-5-(1,3-dioxolan-2-yl)pent-2-en-1-ol
SMILESOC/C=C\CCC1OCCO1
InChIInChI=1S/C8H14O3/c9-5-3-1-2-4-8-10-6-7-11-8/h1,3,8-9H,2,4-7H2/b3-1-
InChIKeyUNTBGDBBOXHHSB-IWQZZHSRSA-N
MW158.20 g/mol
LogP0.69
Rot. Bonds4

About (Z)-5-(1,3-dioxolan-2-yl)pent-2-en-1-ol

(Z)-5-(1,3-dioxolan-2-yl)pent-2-en-1-ol (PubChem CID 68873060) has the molecular formula C8H14O3 and a molecular weight of 158.20 g/mol. Its IUPAC name is (Z)-5-(1,3-dioxolan-2-yl)pent-2-en-1-ol.

Molecular Properties

Compound Name(Z)-5-(1,3-dioxolan-2-yl)pent-2-en-1-ol
PubChem CID68873060
Molecular FormulaC8H14O3
Molecular Weight158.20 g/mol
Exact Mass158.09
IUPAC Name(Z)-5-(1,3-dioxolan-2-yl)pent-2-en-1-ol
SMILESOC/C=C\CCC1OCCO1
InChIInChI=1S/C8H14O3/c9-5-3-1-2-4-8-10-6-7-11-8/h1,3,8-9H,2,4-7H2/b3-1-
InChIKeyUNTBGDBBOXHHSB-IWQZZHSRSA-N
XLogP0.69
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 50.69
H-Bond Donors ≤ 51
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 (Z)-5-(1,3-dioxolan-2-yl)pent-2-en-1-ol?
The IUPAC name of (Z)-5-(1,3-dioxolan-2-yl)pent-2-en-1-ol (CID 68873060) is (Z)-5-(1,3-dioxolan-2-yl)pent-2-en-1-ol.
What is the SMILES notation for (Z)-5-(1,3-dioxolan-2-yl)pent-2-en-1-ol?
The canonical SMILES for (Z)-5-(1,3-dioxolan-2-yl)pent-2-en-1-ol is OC/C=C\CCC1OCCO1.
What is the InChIKey of (Z)-5-(1,3-dioxolan-2-yl)pent-2-en-1-ol?
The InChIKey is UNTBGDBBOXHHSB-IWQZZHSRSA-N. The full InChI is InChI=1S/C8H14O3/c9-5-3-1-2-4-8-10-6-7-11-8/h1,3,8-9H,2,4-7H2/b3-1-.
What are the key properties of (Z)-5-(1,3-dioxolan-2-yl)pent-2-en-1-ol?
(Z)-5-(1,3-dioxolan-2-yl)pent-2-en-1-ol has a molecular weight of 158.20 g/mol, XLogP of 0.69, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-5-(1,3-dioxolan-2-yl)pent-2-en-1-ol is sourced from PubChem (CID 68873060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).