(Z)-1-ethoxy-4-methylpent-1-ene

C8H16O — CID 5462938

IUPAC(Z)-1-ethoxy-4-methylpent-1-ene
SMILESCCO/C=C\CC(C)C
InChIInChI=1S/C8H16O/c1-4-9-7-5-6-8(2)3/h5,7-8H,4,6H2,1-3H3/b7-5-
InChIKeyPEGWCMWUBAGRKQ-ALCCZGGFSA-N
MW128.21 g/mol
LogP2.58
Rot. Bonds4

About (Z)-1-ethoxy-4-methylpent-1-ene

(Z)-1-ethoxy-4-methylpent-1-ene (PubChem CID 5462938) has the molecular formula C8H16O and a molecular weight of 128.21 g/mol. Its IUPAC name is (Z)-1-ethoxy-4-methylpent-1-ene.

Molecular Properties

Compound Name(Z)-1-ethoxy-4-methylpent-1-ene
PubChem CID5462938
Molecular FormulaC8H16O
Molecular Weight128.21 g/mol
Exact Mass128.12
IUPAC Name(Z)-1-ethoxy-4-methylpent-1-ene
SMILESCCO/C=C\CC(C)C
InChIInChI=1S/C8H16O/c1-4-9-7-5-6-8(2)3/h5,7-8H,4,6H2,1-3H3/b7-5-
InChIKeyPEGWCMWUBAGRKQ-ALCCZGGFSA-N
XLogP2.58
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.21
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-1-ethoxy-4-methylpent-1-ene?
The IUPAC name of (Z)-1-ethoxy-4-methylpent-1-ene (CID 5462938) is (Z)-1-ethoxy-4-methylpent-1-ene.
What is the SMILES notation for (Z)-1-ethoxy-4-methylpent-1-ene?
The canonical SMILES for (Z)-1-ethoxy-4-methylpent-1-ene is CCO/C=C\CC(C)C.
What is the InChIKey of (Z)-1-ethoxy-4-methylpent-1-ene?
The InChIKey is PEGWCMWUBAGRKQ-ALCCZGGFSA-N. The full InChI is InChI=1S/C8H16O/c1-4-9-7-5-6-8(2)3/h5,7-8H,4,6H2,1-3H3/b7-5-.
What are the key properties of (Z)-1-ethoxy-4-methylpent-1-ene?
(Z)-1-ethoxy-4-methylpent-1-ene has a molecular weight of 128.21 g/mol, XLogP of 2.58, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-ethoxy-4-methylpent-1-ene is sourced from PubChem (CID 5462938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).