(E)-4-ethenoxyundec-2-ene

C13H24O — CID 10845578

IUPAC(E)-4-ethenoxyundec-2-ene
SMILESC=COC(/C=C/C)CCCCCCC
InChIInChI=1S/C13H24O/c1-4-7-8-9-10-12-13(11-5-2)14-6-3/h5-6,11,13H,3-4,7-10,12H2,1-2H3/b11-5+
InChIKeySBBLDPZYIVVGEG-VZUCSPMQSA-N
MW196.33 g/mol
LogP4.45
Rot. Bonds9

About (E)-4-ethenoxyundec-2-ene

(E)-4-ethenoxyundec-2-ene (PubChem CID 10845578) has the molecular formula C13H24O and a molecular weight of 196.33 g/mol. Its IUPAC name is (E)-4-ethenoxyundec-2-ene.

Molecular Properties

Compound Name(E)-4-ethenoxyundec-2-ene
PubChem CID10845578
Molecular FormulaC13H24O
Molecular Weight196.33 g/mol
Exact Mass196.18
IUPAC Name(E)-4-ethenoxyundec-2-ene
SMILESC=COC(/C=C/C)CCCCCCC
InChIInChI=1S/C13H24O/c1-4-7-8-9-10-12-13(11-5-2)14-6-3/h5-6,11,13H,3-4,7-10,12H2,1-2H3/b11-5+
InChIKeySBBLDPZYIVVGEG-VZUCSPMQSA-N
XLogP4.45
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.33
LogP ≤ 54.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

trans-11S,12S-Epoxy-6Z,9Z-heneicosadiene
CID 10494907
(3R)-3-heptyl-3,6-dihydro-1,2-dioxine
CID 12162655
(3R,6S)-3-heptyl-6-propyl-3,6-dihydro-1,2-dioxine
CID 16727772
1-Nonen-3-ol, methyl ether
CID 12563924
2-Hexyl-4-methyl-3-prop-2-enyl-2,5-dihydrofuran
CID 10943714
2-Hexyl-3-prop-2-enyl-2,5-dihydrofuran
CID 11030687
(E)-4-ethenoxyoct-2-ene
CID 12163450
2-[(E)-dec-1-enyl]oxolane
CID 12735918
3-Butyl-2-methyl-4-prop-2-enyl-2,5-dihydrofuran
CID 15892522
2,3-Dibutyl-4-prop-2-enyl-2,5-dihydrofuran
CID 15892523
2-Butyl-3,4-bis(prop-2-enyl)-2,5-dihydrofuran
CID 15892525
2-Hexyl-2,5-dihydrofuran
CID 10855696

Frequently Asked Questions

What is the IUPAC name of (E)-4-ethenoxyundec-2-ene?
The IUPAC name of (E)-4-ethenoxyundec-2-ene (CID 10845578) is (E)-4-ethenoxyundec-2-ene.
What is the SMILES notation for (E)-4-ethenoxyundec-2-ene?
The canonical SMILES for (E)-4-ethenoxyundec-2-ene is C=COC(/C=C/C)CCCCCCC.
What is the InChIKey of (E)-4-ethenoxyundec-2-ene?
The InChIKey is SBBLDPZYIVVGEG-VZUCSPMQSA-N. The full InChI is InChI=1S/C13H24O/c1-4-7-8-9-10-12-13(11-5-2)14-6-3/h5-6,11,13H,3-4,7-10,12H2,1-2H3/b11-5+.
What are the key properties of (E)-4-ethenoxyundec-2-ene?
(E)-4-ethenoxyundec-2-ene has a molecular weight of 196.33 g/mol, XLogP of 4.45, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-4-ethenoxyundec-2-ene is sourced from PubChem (CID 10845578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).