1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]-2-[2-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]ethoxy]ethane

C20H38O9 — CID 139860327

IUPAC1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]-2-[2-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]ethoxy]ethane
SMILESC=COCCOCCOCCOCCOCCOCCOCCOCCOC=C
InChIInChI=1S/C20H38O9/c1-3-21-5-7-23-9-11-25-13-15-27-17-19-29-20-18-28-16-14-26-12-10-24-8-6-22-4-2/h3-4H,1-2,5-20H2
InChIKeyKVVCNXRBYYLQDL-UHFFFAOYSA-N
MW422.52 g/mol
LogP1.42
Rot. Bonds26

About 1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]-2-[2-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]ethoxy]ethane

1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]-2-[2-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]ethoxy]ethane (PubChem CID 139860327) has the molecular formula C20H38O9 and a molecular weight of 422.52 g/mol. Its IUPAC name is 1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]-2-[2-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]ethoxy]ethane.

Molecular Properties

Compound Name1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]-2-[2-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]ethoxy]ethane
PubChem CID139860327
Molecular FormulaC20H38O9
Molecular Weight422.52 g/mol
Exact Mass422.25
IUPAC Name1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]-2-[2-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]ethoxy]ethane
SMILESC=COCCOCCOCCOCCOCCOCCOCCOCCOC=C
InChIInChI=1S/C20H38O9/c1-3-21-5-7-23-9-11-25-13-15-27-17-19-29-20-18-28-16-14-26-12-10-24-8-6-22-4-2/h3-4H,1-2,5-20H2
InChIKeyKVVCNXRBYYLQDL-UHFFFAOYSA-N
XLogP1.42
TPSA83.07 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds26
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.52
LogP ≤ 51.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

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

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CID 3033992
3,6,9,12,15,18-Hexaoxaicosa-1,19-diene
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2,5,8,11-Tetraoxatridec-12-ene
CID 3273081
3,6,9,12,15-Pentaoxaheptadeca-1,16-diene
CID 4460652
24-Crown-8
CID 10893545
Tetraethylene glycol methyl vinyl ether
CID 5083600
(17Z)-1,4,7,10,13,16-hexaoxacyclooctadec-17-ene
CID 78673825
1,4,7,10,13,16,19,22,25,28-Decaoxacyclotriacontane
CID 11080690
1,4,7,10,13,16,19,22,25,28,31,34,37,40-Tetradecaoxacyclodotetracontane
CID 14295344
2,5,8,11,14,17-Hexaoxanonadec-18-ene
CID 21290489
1,4,7,10,13,16-Hexaoxacyclooctadeca-8,17-diene
CID 53988689
3,6,9,12,15,18,21-Heptaoxatricosa-1,22-diene
CID 15354985

Frequently Asked Questions

What is the IUPAC name of 1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]-2-[2-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]ethoxy]ethane?
The IUPAC name of 1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]-2-[2-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]ethoxy]ethane (CID 139860327) is 1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]-2-[2-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]ethoxy]ethane.
What is the SMILES notation for 1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]-2-[2-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]ethoxy]ethane?
The canonical SMILES for 1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]-2-[2-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]ethoxy]ethane is C=COCCOCCOCCOCCOCCOCCOCCOCCOC=C.
What is the InChIKey of 1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]-2-[2-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]ethoxy]ethane?
The InChIKey is KVVCNXRBYYLQDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H38O9/c1-3-21-5-7-23-9-11-25-13-15-27-17-19-29-20-18-28-16-14-26-12-10-24-8-6-22-4-2/h3-4H,1-2,5-20H2.
What are the key properties of 1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]-2-[2-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]ethoxy]ethane?
1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]-2-[2-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]ethoxy]ethane has a molecular weight of 422.52 g/mol, XLogP of 1.42, 26 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]-2-[2-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]ethoxy]ethane is sourced from PubChem (CID 139860327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).