4-prop-1-enoxyoxane

C8H14O2 — CID 90717252

IUPAC4-prop-1-enoxyoxane
SMILESCC=COC1CCOCC1
InChIInChI=1S/C8H14O2/c1-2-5-10-8-3-6-9-7-4-8/h2,5,8H,3-4,6-7H2,1H3
InChIKeyXVHIVAZPLRQBHM-UHFFFAOYSA-N
MW142.20 g/mol
LogP1.72
Rot. Bonds2

About 4-prop-1-enoxyoxane

4-prop-1-enoxyoxane (PubChem CID 90717252) has the molecular formula C8H14O2 and a molecular weight of 142.20 g/mol. Its IUPAC name is 4-prop-1-enoxyoxane.

Molecular Properties

Compound Name4-prop-1-enoxyoxane
PubChem CID90717252
Molecular FormulaC8H14O2
Molecular Weight142.20 g/mol
Exact Mass142.10
IUPAC Name4-prop-1-enoxyoxane
SMILESCC=COC1CCOCC1
InChIInChI=1S/C8H14O2/c1-2-5-10-8-3-6-9-7-4-8/h2,5,8H,3-4,6-7H2,1H3
InChIKeyXVHIVAZPLRQBHM-UHFFFAOYSA-N
XLogP1.72
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 51.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

4-Prop-1-en-2-yloxyoxane
CID 134275485
2-[[(E)-prop-1-enoxy]methyl]-1,4-dioxane
CID 176603110
4-[(E)-prop-1-enoxy]oxane
CID 176603182
4-(2-Methylprop-1-enoxy)oxane
CID 176604815
2-[1-[(E)-prop-1-enoxy]ethyl]-1,4-dioxane
CID 176604951
3-[(E)-prop-1-enoxy]oxane
CID 176605173
2-[2-[(E)-prop-1-enoxy]ethyl]oxane
CID 176605307
4-(Cyclopropen-1-yloxy)oxane
CID 164918189

Frequently Asked Questions

What is the IUPAC name of 4-prop-1-enoxyoxane?
The IUPAC name of 4-prop-1-enoxyoxane (CID 90717252) is 4-prop-1-enoxyoxane.
What is the SMILES notation for 4-prop-1-enoxyoxane?
The canonical SMILES for 4-prop-1-enoxyoxane is CC=COC1CCOCC1.
What is the InChIKey of 4-prop-1-enoxyoxane?
The InChIKey is XVHIVAZPLRQBHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O2/c1-2-5-10-8-3-6-9-7-4-8/h2,5,8H,3-4,6-7H2,1H3.
What are the key properties of 4-prop-1-enoxyoxane?
4-prop-1-enoxyoxane has a molecular weight of 142.20 g/mol, XLogP of 1.72, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-prop-1-enoxyoxane is sourced from PubChem (CID 90717252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).