4-[1-[2-(2-methoxyethoxy)ethoxy]ethenyl]-2-methyloxane

C13H24O4 — CID 143374559

IUPAC4-[1-[2-(2-methoxyethoxy)ethoxy]ethenyl]-2-methyloxane
SMILESC=C(OCCOCCOC)C1CCOC(C)C1
InChIInChI=1S/C13H24O4/c1-11-10-13(4-5-16-11)12(2)17-9-8-15-7-6-14-3/h11,13H,2,4-10H2,1,3H3
InChIKeyPMNIQOKYFLAPPB-UHFFFAOYSA-N
MW244.33 g/mol
LogP1.99
Rot. Bonds8

About 4-[1-[2-(2-methoxyethoxy)ethoxy]ethenyl]-2-methyloxane

4-[1-[2-(2-methoxyethoxy)ethoxy]ethenyl]-2-methyloxane (PubChem CID 143374559) has the molecular formula C13H24O4 and a molecular weight of 244.33 g/mol. Its IUPAC name is 4-[1-[2-(2-methoxyethoxy)ethoxy]ethenyl]-2-methyloxane.

Molecular Properties

Compound Name4-[1-[2-(2-methoxyethoxy)ethoxy]ethenyl]-2-methyloxane
PubChem CID143374559
Molecular FormulaC13H24O4
Molecular Weight244.33 g/mol
Exact Mass244.17
IUPAC Name4-[1-[2-(2-methoxyethoxy)ethoxy]ethenyl]-2-methyloxane
SMILESC=C(OCCOCCOC)C1CCOC(C)C1
InChIInChI=1S/C13H24O4/c1-11-10-13(4-5-16-11)12(2)17-9-8-15-7-6-14-3/h11,13H,2,4-10H2,1,3H3
InChIKeyPMNIQOKYFLAPPB-UHFFFAOYSA-N
XLogP1.99
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.33
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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

3-(3,7-Dimethyloct-6-enoxy)oxane
CID 558921
3,4,6-Trimethyl-2-methylideneoxane
CID 20614547
(2R,3R)-2,3-dimethyl-6-methylideneoxane
CID 58223661
5-ethoxy-2-ethyl-3,4-dimethyl-3,4-dihydro-2H-pyran
CID 67917175
2,3-Dimethyl-6-methylideneoxane
CID 76707743
(2S,4R)-2,4-dimethyl-6-methylideneoxane
CID 89243381
(2,4-Dimethyl-6-methylideneoxan-3-yl) acetate
CID 91050382
2-Methyl-4-[1-(2-methyloxan-4-yl)ethenoxymethyl]oxane
CID 142140596
2-Methyl-4-(non-1-en-2-yloxymethyl)oxane
CID 143295918
Ethane;4-[1-[2-(2-methoxyethoxy)ethoxy]ethenyl]-2-methyloxane
CID 143374558
2-(3-Methylpent-1-enoxymethyl)oxane
CID 150349362
3-Methoxy-2,2-dimethyl-6-methylideneoxane;propane-2,2-diol
CID 153365136

Frequently Asked Questions

What is the IUPAC name of 4-[1-[2-(2-methoxyethoxy)ethoxy]ethenyl]-2-methyloxane?
The IUPAC name of 4-[1-[2-(2-methoxyethoxy)ethoxy]ethenyl]-2-methyloxane (CID 143374559) is 4-[1-[2-(2-methoxyethoxy)ethoxy]ethenyl]-2-methyloxane.
What is the SMILES notation for 4-[1-[2-(2-methoxyethoxy)ethoxy]ethenyl]-2-methyloxane?
The canonical SMILES for 4-[1-[2-(2-methoxyethoxy)ethoxy]ethenyl]-2-methyloxane is C=C(OCCOCCOC)C1CCOC(C)C1.
What is the InChIKey of 4-[1-[2-(2-methoxyethoxy)ethoxy]ethenyl]-2-methyloxane?
The InChIKey is PMNIQOKYFLAPPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24O4/c1-11-10-13(4-5-16-11)12(2)17-9-8-15-7-6-14-3/h11,13H,2,4-10H2,1,3H3.
What are the key properties of 4-[1-[2-(2-methoxyethoxy)ethoxy]ethenyl]-2-methyloxane?
4-[1-[2-(2-methoxyethoxy)ethoxy]ethenyl]-2-methyloxane has a molecular weight of 244.33 g/mol, XLogP of 1.99, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-[2-(2-methoxyethoxy)ethoxy]ethenyl]-2-methyloxane is sourced from PubChem (CID 143374559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).