5-methoxy-4-(methoxymethyl)pent-1-ene

C8H16O2 — CID 23405720

IUPAC5-methoxy-4-(methoxymethyl)pent-1-ene
SMILESC=CCC(COC)COC
InChIInChI=1S/C8H16O2/c1-4-5-8(6-9-2)7-10-3/h4,8H,1,5-7H2,2-3H3
InChIKeyPQKVCGFWZLHMEU-UHFFFAOYSA-N
MW144.21 g/mol
LogP1.47
Rot. Bonds6

About 5-methoxy-4-(methoxymethyl)pent-1-ene

5-methoxy-4-(methoxymethyl)pent-1-ene (PubChem CID 23405720) has the molecular formula C8H16O2 and a molecular weight of 144.21 g/mol. Its IUPAC name is 5-methoxy-4-(methoxymethyl)pent-1-ene.

Molecular Properties

Compound Name5-methoxy-4-(methoxymethyl)pent-1-ene
PubChem CID23405720
Molecular FormulaC8H16O2
Molecular Weight144.21 g/mol
Exact Mass144.12
IUPAC Name5-methoxy-4-(methoxymethyl)pent-1-ene
SMILESC=CCC(COC)COC
InChIInChI=1S/C8H16O2/c1-4-5-8(6-9-2)7-10-3/h4,8H,1,5-7H2,2-3H3
InChIKeyPQKVCGFWZLHMEU-UHFFFAOYSA-N
XLogP1.47
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.21
LogP ≤ 51.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 5-methoxy-4-(methoxymethyl)pent-1-ene?
The IUPAC name of 5-methoxy-4-(methoxymethyl)pent-1-ene (CID 23405720) is 5-methoxy-4-(methoxymethyl)pent-1-ene.
What is the SMILES notation for 5-methoxy-4-(methoxymethyl)pent-1-ene?
The canonical SMILES for 5-methoxy-4-(methoxymethyl)pent-1-ene is C=CCC(COC)COC.
What is the InChIKey of 5-methoxy-4-(methoxymethyl)pent-1-ene?
The InChIKey is PQKVCGFWZLHMEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O2/c1-4-5-8(6-9-2)7-10-3/h4,8H,1,5-7H2,2-3H3.
What are the key properties of 5-methoxy-4-(methoxymethyl)pent-1-ene?
5-methoxy-4-(methoxymethyl)pent-1-ene has a molecular weight of 144.21 g/mol, XLogP of 1.47, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-4-(methoxymethyl)pent-1-ene is sourced from PubChem (CID 23405720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).