2-methoxy-3-[(Z)-4-methoxybut-2-enyl]oxolane

C10H18O3 — CID 10375177

IUPAC2-methoxy-3-[(Z)-4-methoxybut-2-enyl]oxolane
SMILESCOC/C=C\CC1CCOC1OC
InChIInChI=1S/C10H18O3/c1-11-7-4-3-5-9-6-8-13-10(9)12-2/h3-4,9-10H,5-8H2,1-2H3/b4-3-
InChIKeyFGZBJOIIGAADFX-ARJAWSKDSA-N
MW186.25 g/mol
LogP1.59
Rot. Bonds5

About 2-methoxy-3-[(Z)-4-methoxybut-2-enyl]oxolane

2-methoxy-3-[(Z)-4-methoxybut-2-enyl]oxolane (PubChem CID 10375177) has the molecular formula C10H18O3 and a molecular weight of 186.25 g/mol. Its IUPAC name is 2-methoxy-3-[(Z)-4-methoxybut-2-enyl]oxolane.

Molecular Properties

Compound Name2-methoxy-3-[(Z)-4-methoxybut-2-enyl]oxolane
PubChem CID10375177
Molecular FormulaC10H18O3
Molecular Weight186.25 g/mol
Exact Mass186.13
IUPAC Name2-methoxy-3-[(Z)-4-methoxybut-2-enyl]oxolane
SMILESCOC/C=C\CC1CCOC1OC
InChIInChI=1S/C10H18O3/c1-11-7-4-3-5-9-6-8-13-10(9)12-2/h3-4,9-10H,5-8H2,1-2H3/b4-3-
InChIKeyFGZBJOIIGAADFX-ARJAWSKDSA-N
XLogP1.59
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 51.59
H-Bond Donors ≤ 50
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-methoxy-3-[(Z)-4-methoxybut-2-enyl]oxolane?
The IUPAC name of 2-methoxy-3-[(Z)-4-methoxybut-2-enyl]oxolane (CID 10375177) is 2-methoxy-3-[(Z)-4-methoxybut-2-enyl]oxolane.
What is the SMILES notation for 2-methoxy-3-[(Z)-4-methoxybut-2-enyl]oxolane?
The canonical SMILES for 2-methoxy-3-[(Z)-4-methoxybut-2-enyl]oxolane is COC/C=C\CC1CCOC1OC.
What is the InChIKey of 2-methoxy-3-[(Z)-4-methoxybut-2-enyl]oxolane?
The InChIKey is FGZBJOIIGAADFX-ARJAWSKDSA-N. The full InChI is InChI=1S/C10H18O3/c1-11-7-4-3-5-9-6-8-13-10(9)12-2/h3-4,9-10H,5-8H2,1-2H3/b4-3-.
What are the key properties of 2-methoxy-3-[(Z)-4-methoxybut-2-enyl]oxolane?
2-methoxy-3-[(Z)-4-methoxybut-2-enyl]oxolane has a molecular weight of 186.25 g/mol, XLogP of 1.59, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-3-[(Z)-4-methoxybut-2-enyl]oxolane is sourced from PubChem (CID 10375177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).