9,9-bis(2-methoxyethoxymethyl)fluorene

C21H26O4 — CID 22561477

IUPAC9,9-bis(2-methoxyethoxymethyl)fluorene
SMILESCOCCOCC1(COCCOC)c2ccccc2-c2ccccc21
InChIInChI=1S/C21H26O4/c1-22-11-13-24-15-21(16-25-14-12-23-2)19-9-5-3-7-17(19)18-8-4-6-10-20(18)21/h3-10H,11-16H2,1-2H3
InChIKeySSVHHEMZFXFZSC-UHFFFAOYSA-N
MW342.44 g/mol
LogP3.28
Rot. Bonds10

About 9,9-bis(2-methoxyethoxymethyl)fluorene

9,9-bis(2-methoxyethoxymethyl)fluorene (PubChem CID 22561477) has the molecular formula C21H26O4 and a molecular weight of 342.44 g/mol. Its IUPAC name is 9,9-bis(2-methoxyethoxymethyl)fluorene.

Molecular Properties

Compound Name9,9-bis(2-methoxyethoxymethyl)fluorene
PubChem CID22561477
Molecular FormulaC21H26O4
Molecular Weight342.44 g/mol
Exact Mass342.18
IUPAC Name9,9-bis(2-methoxyethoxymethyl)fluorene
SMILESCOCCOCC1(COCCOC)c2ccccc2-c2ccccc21
InChIInChI=1S/C21H26O4/c1-22-11-13-24-15-21(16-25-14-12-23-2)19-9-5-3-7-17(19)18-8-4-6-10-20(18)21/h3-10H,11-16H2,1-2H3
InChIKeySSVHHEMZFXFZSC-UHFFFAOYSA-N
XLogP3.28
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 53.28
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 9,9-bis(2-methoxyethoxymethyl)fluorene?
The IUPAC name of 9,9-bis(2-methoxyethoxymethyl)fluorene (CID 22561477) is 9,9-bis(2-methoxyethoxymethyl)fluorene.
What is the SMILES notation for 9,9-bis(2-methoxyethoxymethyl)fluorene?
The canonical SMILES for 9,9-bis(2-methoxyethoxymethyl)fluorene is COCCOCC1(COCCOC)c2ccccc2-c2ccccc21.
What is the InChIKey of 9,9-bis(2-methoxyethoxymethyl)fluorene?
The InChIKey is SSVHHEMZFXFZSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26O4/c1-22-11-13-24-15-21(16-25-14-12-23-2)19-9-5-3-7-17(19)18-8-4-6-10-20(18)21/h3-10H,11-16H2,1-2H3.
What are the key properties of 9,9-bis(2-methoxyethoxymethyl)fluorene?
9,9-bis(2-methoxyethoxymethyl)fluorene has a molecular weight of 342.44 g/mol, XLogP of 3.28, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-bis(2-methoxyethoxymethyl)fluorene is sourced from PubChem (CID 22561477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).