9-(methoxymethyl)-9-(pentoxymethyl)fluorene

C21H26O2 — CID 22140520

IUPAC9-(methoxymethyl)-9-(pentoxymethyl)fluorene
SMILESCCCCCOCC1(COC)c2ccccc2-c2ccccc21
InChIInChI=1S/C21H26O2/c1-3-4-9-14-23-16-21(15-22-2)19-12-7-5-10-17(19)18-11-6-8-13-20(18)21/h5-8,10-13H,3-4,9,14-16H2,1-2H3
InChIKeyWFLVIOIMYKVGLP-UHFFFAOYSA-N
MW310.44 g/mol
LogP4.81
Rot. Bonds8

About 9-(methoxymethyl)-9-(pentoxymethyl)fluorene

9-(methoxymethyl)-9-(pentoxymethyl)fluorene (PubChem CID 22140520) has the molecular formula C21H26O2 and a molecular weight of 310.44 g/mol. Its IUPAC name is 9-(methoxymethyl)-9-(pentoxymethyl)fluorene.

Molecular Properties

Compound Name9-(methoxymethyl)-9-(pentoxymethyl)fluorene
PubChem CID22140520
Molecular FormulaC21H26O2
Molecular Weight310.44 g/mol
Exact Mass310.19
IUPAC Name9-(methoxymethyl)-9-(pentoxymethyl)fluorene
SMILESCCCCCOCC1(COC)c2ccccc2-c2ccccc21
InChIInChI=1S/C21H26O2/c1-3-4-9-14-23-16-21(15-22-2)19-12-7-5-10-17(19)18-11-6-8-13-20(18)21/h5-8,10-13H,3-4,9,14-16H2,1-2H3
InChIKeyWFLVIOIMYKVGLP-UHFFFAOYSA-N
XLogP4.81
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.44
LogP ≤ 54.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

9,9-bis(2-methoxyethoxymethyl)fluorene
CID 22561477
2-[9-(butoxymethyl)fluoren-9-yl]acetaldehyde
CID 174853757
9,9-didecylfluorene
CID 5135289
9,9-di(docosyl)fluorene
CID 22568526
benzyl-dimethyl-[[9-(propoxymethyl)fluoren-9-yl]methoxy]silane
CID 69304675
2,3-dimethoxy-1,1-bis(methoxymethyl)indene
CID 23103653
1-[9-(methoxymethyl)fluoren-9-yl]pentan-1-one
CID 67497909
2-[9-(methoxymethyl)fluoren-9-yl]heptanal
CID 174662792
9,9-bis(methoxymethyl)-2-(2-methylpropyl)fluorene
CID 141021386
dipentyl fluorene-9,9-dicarboxylate
CID 126715860
CID 162235627
CID 162235627
methyl 3-(9-octylfluoren-9-yl)propanoate
CID 58637208

Frequently Asked Questions

What is the IUPAC name of 9-(methoxymethyl)-9-(pentoxymethyl)fluorene?
The IUPAC name of 9-(methoxymethyl)-9-(pentoxymethyl)fluorene (CID 22140520) is 9-(methoxymethyl)-9-(pentoxymethyl)fluorene.
What is the SMILES notation for 9-(methoxymethyl)-9-(pentoxymethyl)fluorene?
The canonical SMILES for 9-(methoxymethyl)-9-(pentoxymethyl)fluorene is CCCCCOCC1(COC)c2ccccc2-c2ccccc21.
What is the InChIKey of 9-(methoxymethyl)-9-(pentoxymethyl)fluorene?
The InChIKey is WFLVIOIMYKVGLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26O2/c1-3-4-9-14-23-16-21(15-22-2)19-12-7-5-10-17(19)18-11-6-8-13-20(18)21/h5-8,10-13H,3-4,9,14-16H2,1-2H3.
What are the key properties of 9-(methoxymethyl)-9-(pentoxymethyl)fluorene?
9-(methoxymethyl)-9-(pentoxymethyl)fluorene has a molecular weight of 310.44 g/mol, XLogP of 4.81, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(methoxymethyl)-9-(pentoxymethyl)fluorene is sourced from PubChem (CID 22140520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).