4-ethoxy-2-methoxypent-2-ene

C8H16O2 — CID 91191675

IUPAC4-ethoxy-2-methoxypent-2-ene
SMILESCCOC(C)C=C(C)OC
InChIInChI=1S/C8H16O2/c1-5-10-8(3)6-7(2)9-4/h6,8H,5H2,1-4H3
InChIKeyBDOQPIOUNHHAOM-UHFFFAOYSA-N
MW144.21 g/mol
LogP1.96
Rot. Bonds4

About 4-ethoxy-2-methoxypent-2-ene

4-ethoxy-2-methoxypent-2-ene (PubChem CID 91191675) has the molecular formula C8H16O2 and a molecular weight of 144.21 g/mol. Its IUPAC name is 4-ethoxy-2-methoxypent-2-ene.

Molecular Properties

Compound Name4-ethoxy-2-methoxypent-2-ene
PubChem CID91191675
Molecular FormulaC8H16O2
Molecular Weight144.21 g/mol
Exact Mass144.12
IUPAC Name4-ethoxy-2-methoxypent-2-ene
SMILESCCOC(C)C=C(C)OC
InChIInChI=1S/C8H16O2/c1-5-10-8(3)6-7(2)9-4/h6,8H,5H2,1-4H3
InChIKeyBDOQPIOUNHHAOM-UHFFFAOYSA-N
XLogP1.96
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.21
LogP ≤ 51.96
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

3,6-dihydro-4-methoxy-2H-pyran
CID 87051
1-Isopropoxy-2,7-octadiene
CID 11286698
1,3,5-Trimethoxycyclohexa-1,4-diene
CID 91534566
2-Ethoxy-1,5-difluoro-4-methoxypent-2-ene
CID 123798607
(3Z,5Z)-3-fluoro-4-[(E)-pent-3-en-2-yl]oxyhepta-1,3,5-triene
CID 134448842
2-Pentene, 4,4'-oxybis-
CID 5365801
(E)-2,5-dimethoxyhex-3-ene
CID 13549008
(2Z,5Z)-4-but-3-enoxyhepta-2,5-diene
CID 11309730
(E)-2-ethenoxyoct-3-ene
CID 12163449
(5E)-4-[(3E)-hepta-3,6-dien-2-yl]oxyhepta-1,5-diene
CID 14111127
(5E)-4-[(5E)-hepta-1,5-dien-4-yl]oxyhepta-1,5-diene
CID 14111128
(4E)-6-[(3E)-hepta-3,6-dien-2-yl]oxyhepta-1,4-diene
CID 14111129

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-2-methoxypent-2-ene?
The IUPAC name of 4-ethoxy-2-methoxypent-2-ene (CID 91191675) is 4-ethoxy-2-methoxypent-2-ene.
What is the SMILES notation for 4-ethoxy-2-methoxypent-2-ene?
The canonical SMILES for 4-ethoxy-2-methoxypent-2-ene is CCOC(C)C=C(C)OC.
What is the InChIKey of 4-ethoxy-2-methoxypent-2-ene?
The InChIKey is BDOQPIOUNHHAOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O2/c1-5-10-8(3)6-7(2)9-4/h6,8H,5H2,1-4H3.
What are the key properties of 4-ethoxy-2-methoxypent-2-ene?
4-ethoxy-2-methoxypent-2-ene has a molecular weight of 144.21 g/mol, XLogP of 1.96, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-2-methoxypent-2-ene is sourced from PubChem (CID 91191675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).