2-[2-[2-[2-[2-[2-[2-[2-[2-(2-tridecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propan-1-ol

C34H70O11 — CID 175740296

IUPAC2-[2-[2-[2-[2-[2-[2-[2-[2-(2-tridecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propan-1-ol
SMILESCCCCCCCCCCCCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC(C)CO
InChIInChI=1S/C34H70O11/c1-3-4-5-6-7-8-9-10-11-12-13-14-36-15-16-37-17-18-38-19-20-39-21-22-40-23-24-41-25-26-42-27-28-43-29-30-44-31-32-45-34(2)33-35/h34-35H,3-33H2,1-2H3
InChIKeyFZHXUIRAWPPJSX-UHFFFAOYSA-N
MW654.92 g/mol
LogP4.84
Rot. Bonds41

About 2-[2-[2-[2-[2-[2-[2-[2-[2-(2-tridecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propan-1-ol

2-[2-[2-[2-[2-[2-[2-[2-[2-(2-tridecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propan-1-ol (PubChem CID 175740296) has the molecular formula C34H70O11 and a molecular weight of 654.92 g/mol. Its IUPAC name is 2-[2-[2-[2-[2-[2-[2-[2-[2-(2-tridecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propan-1-ol.

Molecular Properties

Compound Name2-[2-[2-[2-[2-[2-[2-[2-[2-(2-tridecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propan-1-ol
PubChem CID175740296
Molecular FormulaC34H70O11
Molecular Weight654.92 g/mol
Exact Mass654.49
IUPAC Name2-[2-[2-[2-[2-[2-[2-[2-[2-(2-tridecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propan-1-ol
SMILESCCCCCCCCCCCCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC(C)CO
InChIInChI=1S/C34H70O11/c1-3-4-5-6-7-8-9-10-11-12-13-14-36-15-16-37-17-18-38-19-20-39-21-22-40-23-24-41-25-26-42-27-28-43-29-30-44-31-32-45-34(2)33-35/h34-35H,3-33H2,1-2H3
InChIKeyFZHXUIRAWPPJSX-UHFFFAOYSA-N
XLogP4.84
TPSA112.53 Ų
H-Bond Donors1
H-Bond Acceptors11
Rotatable Bonds41
Heavy Atoms45
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500654.92
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1011

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 2-[2-[2-[2-[2-[2-[2-[2-[2-(2-tridecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propan-1-ol?
The IUPAC name of 2-[2-[2-[2-[2-[2-[2-[2-[2-(2-tridecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propan-1-ol (CID 175740296) is 2-[2-[2-[2-[2-[2-[2-[2-[2-(2-tridecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propan-1-ol.
What is the SMILES notation for 2-[2-[2-[2-[2-[2-[2-[2-[2-(2-tridecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propan-1-ol?
The canonical SMILES for 2-[2-[2-[2-[2-[2-[2-[2-[2-(2-tridecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propan-1-ol is CCCCCCCCCCCCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC(C)CO.
What is the InChIKey of 2-[2-[2-[2-[2-[2-[2-[2-[2-(2-tridecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propan-1-ol?
The InChIKey is FZHXUIRAWPPJSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H70O11/c1-3-4-5-6-7-8-9-10-11-12-13-14-36-15-16-37-17-18-38-19-20-39-21-22-40-23-24-41-25-26-42-27-28-43-29-30-44-31-32-45-34(2)33-35/h34-35H,3-33H2,1-2H3.
What are the key properties of 2-[2-[2-[2-[2-[2-[2-[2-[2-(2-tridecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propan-1-ol?
2-[2-[2-[2-[2-[2-[2-[2-[2-(2-tridecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propan-1-ol has a molecular weight of 654.92 g/mol, XLogP of 4.84, 41 rotatable bonds, 1 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-[2-[2-[2-[2-[2-[2-(2-tridecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propan-1-ol is sourced from PubChem (CID 175740296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).