6-ethyl-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]cyclohexa-1,3-diene

C15H26O4 — CID 70900159

IUPAC6-ethyl-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]cyclohexa-1,3-diene
SMILESCCC1C=C(OCCOCCOCCOC)C=CC1
InChIInChI=1S/C15H26O4/c1-3-14-5-4-6-15(13-14)19-12-11-18-10-9-17-8-7-16-2/h4,6,13-14H,3,5,7-12H2,1-2H3
InChIKeyMCRHNTPAMJAZLS-UHFFFAOYSA-N
MW270.37 g/mol
LogP2.55
Rot. Bonds11

About 6-ethyl-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]cyclohexa-1,3-diene

6-ethyl-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]cyclohexa-1,3-diene (PubChem CID 70900159) has the molecular formula C15H26O4 and a molecular weight of 270.37 g/mol. Its IUPAC name is 6-ethyl-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]cyclohexa-1,3-diene.

Molecular Properties

Compound Name6-ethyl-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]cyclohexa-1,3-diene
PubChem CID70900159
Molecular FormulaC15H26O4
Molecular Weight270.37 g/mol
Exact Mass270.18
IUPAC Name6-ethyl-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]cyclohexa-1,3-diene
SMILESCCC1C=C(OCCOCCOCCOC)C=CC1
InChIInChI=1S/C15H26O4/c1-3-14-5-4-6-15(13-14)19-12-11-18-10-9-17-8-7-16-2/h4,6,13-14H,3,5,7-12H2,1-2H3
InChIKeyMCRHNTPAMJAZLS-UHFFFAOYSA-N
XLogP2.55
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 52.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]cyclohexa-1,3-diene?
The IUPAC name of 6-ethyl-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]cyclohexa-1,3-diene (CID 70900159) is 6-ethyl-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]cyclohexa-1,3-diene.
What is the SMILES notation for 6-ethyl-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]cyclohexa-1,3-diene?
The canonical SMILES for 6-ethyl-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]cyclohexa-1,3-diene is CCC1C=C(OCCOCCOCCOC)C=CC1.
What is the InChIKey of 6-ethyl-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]cyclohexa-1,3-diene?
The InChIKey is MCRHNTPAMJAZLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26O4/c1-3-14-5-4-6-15(13-14)19-12-11-18-10-9-17-8-7-16-2/h4,6,13-14H,3,5,7-12H2,1-2H3.
What are the key properties of 6-ethyl-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]cyclohexa-1,3-diene?
6-ethyl-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]cyclohexa-1,3-diene has a molecular weight of 270.37 g/mol, XLogP of 2.55, 11 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]cyclohexa-1,3-diene is sourced from PubChem (CID 70900159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).