1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]heptane

C14H30O4 — CID 44593867

IUPAC1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]heptane
SMILESCCCCCCCOCCOCCOCCOC
InChIInChI=1S/C14H30O4/c1-3-4-5-6-7-8-16-11-12-18-14-13-17-10-9-15-2/h3-14H2,1-2H3
InChIKeyNRRWCWPTUGBNBB-UHFFFAOYSA-N
MW262.39 g/mol
LogP2.65
Rot. Bonds15

About 1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]heptane

1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]heptane (PubChem CID 44593867) has the molecular formula C14H30O4 and a molecular weight of 262.39 g/mol. Its IUPAC name is 1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]heptane.

Molecular Properties

Compound Name1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]heptane
PubChem CID44593867
Molecular FormulaC14H30O4
Molecular Weight262.39 g/mol
Exact Mass262.21
IUPAC Name1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]heptane
SMILESCCCCCCCOCCOCCOCCOC
InChIInChI=1S/C14H30O4/c1-3-4-5-6-7-8-16-11-12-18-14-13-17-10-9-15-2/h3-14H2,1-2H3
InChIKeyNRRWCWPTUGBNBB-UHFFFAOYSA-N
XLogP2.65
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds15
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.39
LogP ≤ 52.65
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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Related Compounds

1-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]octane
CID 175220502
1-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]octane
CID 151811497
1-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]tetradecane
CID 102000806
1,2-dimethoxyethane;1-hexoxyhexane
CID 174800290
1-[2-(2-butoxyethoxy)ethoxy]butane;1-[2-(2-methoxyethoxy)ethoxy]pentane
CID 157339506
1-[2-[2-[2-[2-(2-pentoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]heptane
CID 150797704
1-[2-(2-tetradecoxyethoxy)ethoxy]tetradecane
CID 10743953
1,8-bis(2-methoxyethoxy)octane
CID 143118909
1-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hexadecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]octadecane
CID 86345710
1-(2-octoxyethoxy)octane
CID 12711862
1-[2-[2-[2-[2-[2-(2-hexoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]octane
CID 151767279
1-[2-(2-heptoxyethoxy)ethoxy]heptane
CID 14402381

Frequently Asked Questions

What is the IUPAC name of 1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]heptane?
The IUPAC name of 1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]heptane (CID 44593867) is 1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]heptane.
What is the SMILES notation for 1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]heptane?
The canonical SMILES for 1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]heptane is CCCCCCCOCCOCCOCCOC.
What is the InChIKey of 1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]heptane?
The InChIKey is NRRWCWPTUGBNBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30O4/c1-3-4-5-6-7-8-16-11-12-18-14-13-17-10-9-15-2/h3-14H2,1-2H3.
What are the key properties of 1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]heptane?
1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]heptane has a molecular weight of 262.39 g/mol, XLogP of 2.65, 15 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]heptane is sourced from PubChem (CID 44593867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).