9,9-bis[3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propyl]-2,7-dimethylfluorene

C67H118O24 — CID 58473586

IUPAC9,9-bis[3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propyl]-2,7-dimethylfluorene
SMILESCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCCC1(CCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC)c2cc(C)ccc2-c2ccc(C)cc21
InChIInChI=1S/C67H118O24/c1-61-7-9-63-64-10-8-62(2)60-66(64)67(65(63)59-61,11-5-13-70-19-21-74-27-29-78-35-37-82-43-45-86-51-53-90-57-55-88-49-47-84-41-39-80-33-31-76-25-23-72-17-15-68-3)12-6-14-71-20-22-75-28-30-79-36-38-83-44-46-87-52-54-91-58-56-89-50-48-85-42-40-81-34-32-77-26-24-73-18-16-69-4/h7-10,59-60H,5-6,11-58H2,1-4H3
InChIKeyIDAGSQCVXGVIBS-UHFFFAOYSA-N
MW1307.66 g/mol
LogP5.79
Rot. Bonds74

About 9,9-bis[3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propyl]-2,7-dimethylfluorene

9,9-bis[3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propyl]-2,7-dimethylfluorene (PubChem CID 58473586) has the molecular formula C67H118O24 and a molecular weight of 1307.66 g/mol. Its IUPAC name is 9,9-bis[3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propyl]-2,7-dimethylfluorene.

Molecular Properties

Compound Name9,9-bis[3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propyl]-2,7-dimethylfluorene
PubChem CID58473586
Molecular FormulaC67H118O24
Molecular Weight1307.66 g/mol
Exact Mass1306.80
IUPAC Name9,9-bis[3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propyl]-2,7-dimethylfluorene
SMILESCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCCC1(CCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC)c2cc(C)ccc2-c2ccc(C)cc21
InChIInChI=1S/C67H118O24/c1-61-7-9-63-64-10-8-62(2)60-66(64)67(65(63)59-61,11-5-13-70-19-21-74-27-29-78-35-37-82-43-45-86-51-53-90-57-55-88-49-47-84-41-39-80-33-31-76-25-23-72-17-15-68-3)12-6-14-71-20-22-75-28-30-79-36-38-83-44-46-87-52-54-91-58-56-89-50-48-85-42-40-81-34-32-77-26-24-73-18-16-69-4/h7-10,59-60H,5-6,11-58H2,1-4H3
InChIKeyIDAGSQCVXGVIBS-UHFFFAOYSA-N
XLogP5.79
TPSA221.52 Ų
H-Bond Donors
H-Bond Acceptors24
Rotatable Bonds74
Heavy Atoms91
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001307.66
LogP ≤ 55.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1024

Computed Properties (RDKit)

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

Analyze 9,9-bis[3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propyl]-2,7-dimethylfluorene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 9,9-bis[3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propyl]-2,7-dimethylfluorene?
The IUPAC name of 9,9-bis[3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propyl]-2,7-dimethylfluorene (CID 58473586) is 9,9-bis[3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propyl]-2,7-dimethylfluorene.
What is the SMILES notation for 9,9-bis[3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propyl]-2,7-dimethylfluorene?
The canonical SMILES for 9,9-bis[3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propyl]-2,7-dimethylfluorene is COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCCC1(CCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC)c2cc(C)ccc2-c2ccc(C)cc21.
What is the InChIKey of 9,9-bis[3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propyl]-2,7-dimethylfluorene?
The InChIKey is IDAGSQCVXGVIBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C67H118O24/c1-61-7-9-63-64-10-8-62(2)60-66(64)67(65(63)59-61,11-5-13-70-19-21-74-27-29-78-35-37-82-43-45-86-51-53-90-57-55-88-49-47-84-41-39-80-33-31-76-25-23-72-17-15-68-3)12-6-14-71-20-22-75-28-30-79-36-38-83-44-46-87-52-54-91-58-56-89-50-48-85-42-40-81-34-32-77-26-24-73-18-16-69-4/h7-10,59-60H,5-6,11-58H2,1-4H3.
What are the key properties of 9,9-bis[3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propyl]-2,7-dimethylfluorene?
9,9-bis[3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propyl]-2,7-dimethylfluorene has a molecular weight of 1307.66 g/mol, XLogP of 5.79, 74 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-bis[3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propyl]-2,7-dimethylfluorene is sourced from PubChem (CID 58473586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).