4-ethenoxyundec-1-ene

C13H24O — CID 101420327

IUPAC4-ethenoxyundec-1-ene
SMILESC=CCC(CCCCCCC)OC=C
InChIInChI=1S/C13H24O/c1-4-7-8-9-10-12-13(11-5-2)14-6-3/h5-6,13H,2-4,7-12H2,1H3
InChIKeyZQULIUHYRMZZTC-UHFFFAOYSA-N
MW196.33 g/mol
LogP4.45
Rot. Bonds10

About 4-ethenoxyundec-1-ene

4-ethenoxyundec-1-ene (PubChem CID 101420327) has the molecular formula C13H24O and a molecular weight of 196.33 g/mol. Its IUPAC name is 4-ethenoxyundec-1-ene.

Molecular Properties

Compound Name4-ethenoxyundec-1-ene
PubChem CID101420327
Molecular FormulaC13H24O
Molecular Weight196.33 g/mol
Exact Mass196.18
IUPAC Name4-ethenoxyundec-1-ene
SMILESC=CCC(CCCCCCC)OC=C
InChIInChI=1S/C13H24O/c1-4-7-8-9-10-12-13(11-5-2)14-6-3/h5-6,13H,2-4,7-12H2,1H3
InChIKeyZQULIUHYRMZZTC-UHFFFAOYSA-N
XLogP4.45
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
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

4-methoxynon-1-ene
CID 13284925
5-ethenoxy-13-prop-2-enoxyheptadecane
CID 126747600
oct-1-en-4-yl formate
CID 87501677
(4R)-4-(methoxymethoxy)undec-1-ene
CID 102130866
1,1-bis(ethenoxy)octadecane
CID 19822568
4-oct-1-en-4-ylperoxyoct-1-ene
CID 87401104
3-ethenoxy-1,1,1-trimethoxytridecane
CID 152669941
4-(methoxymethoxy)non-1-ene
CID 14592865
nonadec-1-en-4-yl prop-2-enoate
CID 11393552
tributyl(dec-1-en-4-yloxymethyl)stannane
CID 71337213
17-prop-2-enyltetratriacontane
CID 173452630
4-prop-2-enylpentadec-1-ene
CID 54427529

Frequently Asked Questions

What is the IUPAC name of 4-ethenoxyundec-1-ene?
The IUPAC name of 4-ethenoxyundec-1-ene (CID 101420327) is 4-ethenoxyundec-1-ene.
What is the SMILES notation for 4-ethenoxyundec-1-ene?
The canonical SMILES for 4-ethenoxyundec-1-ene is C=CCC(CCCCCCC)OC=C.
What is the InChIKey of 4-ethenoxyundec-1-ene?
The InChIKey is ZQULIUHYRMZZTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24O/c1-4-7-8-9-10-12-13(11-5-2)14-6-3/h5-6,13H,2-4,7-12H2,1H3.
What are the key properties of 4-ethenoxyundec-1-ene?
4-ethenoxyundec-1-ene has a molecular weight of 196.33 g/mol, XLogP of 4.45, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenoxyundec-1-ene is sourced from PubChem (CID 101420327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).