(E)-1-[(Z)-but-1-enoxy]pent-1-ene

C9H16O — CID 173340391

IUPAC(E)-1-[(Z)-but-1-enoxy]pent-1-ene
SMILESCC/C=C\O/C=C/CCC
InChIInChI=1S/C9H16O/c1-3-5-7-9-10-8-6-4-2/h6-9H,3-5H2,1-2H3/b8-6-,9-7+
InChIKeyRGARGYYOSFQGBX-MKKAVFGOSA-N
MW140.23 g/mol
LogP3.24
Rot. Bonds5

About (E)-1-[(Z)-but-1-enoxy]pent-1-ene

(E)-1-[(Z)-but-1-enoxy]pent-1-ene (PubChem CID 173340391) has the molecular formula C9H16O and a molecular weight of 140.23 g/mol. Its IUPAC name is (E)-1-[(Z)-but-1-enoxy]pent-1-ene.

Molecular Properties

Compound Name(E)-1-[(Z)-but-1-enoxy]pent-1-ene
PubChem CID173340391
Molecular FormulaC9H16O
Molecular Weight140.23 g/mol
Exact Mass140.12
IUPAC Name(E)-1-[(Z)-but-1-enoxy]pent-1-ene
SMILESCC/C=C\O/C=C/CCC
InChIInChI=1S/C9H16O/c1-3-5-7-9-10-8-6-4-2/h6-9H,3-5H2,1-2H3/b8-6-,9-7+
InChIKeyRGARGYYOSFQGBX-MKKAVFGOSA-N
XLogP3.24
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 53.24
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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Related Compounds

1-but-1-enoxybut-1-ene;dibutyltin
CID 175169500
1-triacont-1-enoxytriacont-1-ene
CID 173373575
1-hexadec-1-enoxyhexadec-1-ene
CID 57140599
(Z)-1-ethoxypent-1-ene
CID 12512190
(E)-1-ethenoxybut-1-ene
CID 173170076
1-but-1-enoxybut-1-ene;3-prop-2-enoxyprop-1-ene
CID 173130431
ethene;(Z)-hept-3-ene
CID 142517945
1-prop-1-enoxyhex-1-ene
CID 57015059
(Z)-hex-2-ene;(E)-hex-2-ene;(E)-hex-3-ene
CID 173035981
(4Z,8E)-dodeca-4,8-diene
CID 12576906
(4E,8E)-dodeca-4,8-diene
CID 12576905
ethane;(E)-oct-4-ene
CID 142055407

Frequently Asked Questions

What is the IUPAC name of (E)-1-[(Z)-but-1-enoxy]pent-1-ene?
The IUPAC name of (E)-1-[(Z)-but-1-enoxy]pent-1-ene (CID 173340391) is (E)-1-[(Z)-but-1-enoxy]pent-1-ene.
What is the SMILES notation for (E)-1-[(Z)-but-1-enoxy]pent-1-ene?
The canonical SMILES for (E)-1-[(Z)-but-1-enoxy]pent-1-ene is CC/C=C\O/C=C/CCC.
What is the InChIKey of (E)-1-[(Z)-but-1-enoxy]pent-1-ene?
The InChIKey is RGARGYYOSFQGBX-MKKAVFGOSA-N. The full InChI is InChI=1S/C9H16O/c1-3-5-7-9-10-8-6-4-2/h6-9H,3-5H2,1-2H3/b8-6-,9-7+.
What are the key properties of (E)-1-[(Z)-but-1-enoxy]pent-1-ene?
(E)-1-[(Z)-but-1-enoxy]pent-1-ene has a molecular weight of 140.23 g/mol, XLogP of 3.24, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-[(Z)-but-1-enoxy]pent-1-ene is sourced from PubChem (CID 173340391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).