5,6-bis[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]hex-1-ene

C20H40O8 — CID 57088262

IUPAC5,6-bis[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]hex-1-ene
SMILESC=CCCC(COCCOCCOCCOC)OCCOCCOCCOC
InChIInChI=1S/C20H40O8/c1-4-5-6-20(28-18-17-26-14-12-24-10-8-22-3)19-27-16-15-25-13-11-23-9-7-21-2/h4,20H,1,5-19H2,2-3H3
InChIKeySOMLDDIVUGWFQF-UHFFFAOYSA-N
MW408.53 g/mol
LogP1.71
Rot. Bonds24

About 5,6-bis[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]hex-1-ene

5,6-bis[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]hex-1-ene (PubChem CID 57088262) has the molecular formula C20H40O8 and a molecular weight of 408.53 g/mol. Its IUPAC name is 5,6-bis[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]hex-1-ene.

Molecular Properties

Compound Name5,6-bis[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]hex-1-ene
PubChem CID57088262
Molecular FormulaC20H40O8
Molecular Weight408.53 g/mol
Exact Mass408.27
IUPAC Name5,6-bis[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]hex-1-ene
SMILESC=CCCC(COCCOCCOCCOC)OCCOCCOCCOC
InChIInChI=1S/C20H40O8/c1-4-5-6-20(28-18-17-26-14-12-24-10-8-22-3)19-27-16-15-25-13-11-23-9-7-21-2/h4,20H,1,5-19H2,2-3H3
InChIKeySOMLDDIVUGWFQF-UHFFFAOYSA-N
XLogP1.71
TPSA73.84 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds24
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.53
LogP ≤ 51.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

5-[2-[2,3-Bis(2-pent-4-enoxyethoxy)propoxy]ethoxy]pent-1-ene
CID 21349204
2-But-3-enyl-1,4,7,10,13,16-hexaoxacyclooctadecane
CID 21811784
4,5-Diethoxyhex-1-ene
CID 57300469
6-[2-[2-[2-[2-[2-[2-[2-(2-Methylperoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]hex-1-ene
CID 57568843
1,2-Bis(pent-4-enoxy)hexane
CID 71465045
1,2-Bis(hex-5-enoxy)hexane
CID 71465046
7-(2-Hept-6-enoxyhexoxy)hept-1-ene
CID 71465047
8-(2-Oct-7-enoxyhexoxy)oct-1-ene
CID 71465050
1-(2-Propan-2-yloxyethoxy)icosa-5,8,11,14-tetraene
CID 85040673
4-[2-[2-[2-(2-Methoxyethoxy)ethoxy]ethoxy]ethoxy]hepta-1,6-diene
CID 87256314
(5Z,8Z,11Z,14Z)-1-(2-propan-2-yloxyethoxy)icosa-5,8,11,14-tetraene
CID 88092118
6-(1,3-Dimethoxypropan-2-yloxy)hex-1-ene
CID 89357161

Frequently Asked Questions

What is the IUPAC name of 5,6-bis[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]hex-1-ene?
The IUPAC name of 5,6-bis[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]hex-1-ene (CID 57088262) is 5,6-bis[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]hex-1-ene.
What is the SMILES notation for 5,6-bis[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]hex-1-ene?
The canonical SMILES for 5,6-bis[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]hex-1-ene is C=CCCC(COCCOCCOCCOC)OCCOCCOCCOC.
What is the InChIKey of 5,6-bis[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]hex-1-ene?
The InChIKey is SOMLDDIVUGWFQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H40O8/c1-4-5-6-20(28-18-17-26-14-12-24-10-8-22-3)19-27-16-15-25-13-11-23-9-7-21-2/h4,20H,1,5-19H2,2-3H3.
What are the key properties of 5,6-bis[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]hex-1-ene?
5,6-bis[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]hex-1-ene has a molecular weight of 408.53 g/mol, XLogP of 1.71, 24 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-bis[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]hex-1-ene is sourced from PubChem (CID 57088262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).