(E)-5-ethoxypent-4-en-1-ol

C7H14O2 — CID 18436659

IUPAC(E)-5-ethoxypent-4-en-1-ol
SMILESCCO/C=C/CCCO
InChIInChI=1S/C7H14O2/c1-2-9-7-5-3-4-6-8/h5,7-8H,2-4,6H2,1H3/b7-5+
InChIKeyOTOFMCNKBVCMHG-FNORWQNLSA-N
MW130.19 g/mol
LogP1.31
Rot. Bonds5

About (E)-5-ethoxypent-4-en-1-ol

(E)-5-ethoxypent-4-en-1-ol (PubChem CID 18436659) has the molecular formula C7H14O2 and a molecular weight of 130.19 g/mol. Its IUPAC name is (E)-5-ethoxypent-4-en-1-ol.

Molecular Properties

Compound Name(E)-5-ethoxypent-4-en-1-ol
PubChem CID18436659
Molecular FormulaC7H14O2
Molecular Weight130.19 g/mol
Exact Mass130.10
IUPAC Name(E)-5-ethoxypent-4-en-1-ol
SMILESCCO/C=C/CCCO
InChIInChI=1S/C7H14O2/c1-2-9-7-5-3-4-6-8/h5,7-8H,2-4,6H2,1H3/b7-5+
InChIKeyOTOFMCNKBVCMHG-FNORWQNLSA-N
XLogP1.31
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.19
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-ethoxyhex-1-ene
CID 53422434
1-ethoxyundec-1-ene
CID 71331710
1-ethoxytridec-1-ene
CID 173032013
(Z)-1-ethoxypent-1-ene
CID 12512190
3-octadec-1-enoxypropan-1-ol
CID 552588
N-[(E)-7-ethoxyhept-6-enyl]-N-methylhydroxylamine
CID 163887723
(Z)-hept-4-en-1-ol
CID 5367536
7-methoxyhept-6-en-1-ol
CID 85279707
2-[2-[2-(2-hept-1-enoxyethoxy)ethoxy]ethoxy]ethanol
CID 86242770
7-(7-hydroxyhept-1-enoxy)hept-6-en-1-ol
CID 57238469
(4E,6Z)-nona-4,6-dien-1-ol
CID 11286515
(E)-nonadec-4-en-1-ol
CID 87881885

Frequently Asked Questions

What is the IUPAC name of (E)-5-ethoxypent-4-en-1-ol?
The IUPAC name of (E)-5-ethoxypent-4-en-1-ol (CID 18436659) is (E)-5-ethoxypent-4-en-1-ol.
What is the SMILES notation for (E)-5-ethoxypent-4-en-1-ol?
The canonical SMILES for (E)-5-ethoxypent-4-en-1-ol is CCO/C=C/CCCO.
What is the InChIKey of (E)-5-ethoxypent-4-en-1-ol?
The InChIKey is OTOFMCNKBVCMHG-FNORWQNLSA-N. The full InChI is InChI=1S/C7H14O2/c1-2-9-7-5-3-4-6-8/h5,7-8H,2-4,6H2,1H3/b7-5+.
What are the key properties of (E)-5-ethoxypent-4-en-1-ol?
(E)-5-ethoxypent-4-en-1-ol has a molecular weight of 130.19 g/mol, XLogP of 1.31, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-5-ethoxypent-4-en-1-ol is sourced from PubChem (CID 18436659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).