9,9-bis(2-methoxyethyl)-2,7-dimethylfluorene

C21H26O2 — CID 58098487

IUPAC9,9-bis(2-methoxyethyl)-2,7-dimethylfluorene
SMILESCOCCC1(CCOC)c2cc(C)ccc2-c2ccc(C)cc21
InChIInChI=1S/C21H26O2/c1-15-5-7-17-18-8-6-16(2)14-20(18)21(9-11-22-3,10-12-23-4)19(17)13-15/h5-8,13-14H,9-12H2,1-4H3
InChIKeyWRCLLZROMIOFKA-UHFFFAOYSA-N
MW310.44 g/mol
LogP4.64
Rot. Bonds6

About 9,9-bis(2-methoxyethyl)-2,7-dimethylfluorene

9,9-bis(2-methoxyethyl)-2,7-dimethylfluorene (PubChem CID 58098487) has the molecular formula C21H26O2 and a molecular weight of 310.44 g/mol. Its IUPAC name is 9,9-bis(2-methoxyethyl)-2,7-dimethylfluorene.

Molecular Properties

Compound Name9,9-bis(2-methoxyethyl)-2,7-dimethylfluorene
PubChem CID58098487
Molecular FormulaC21H26O2
Molecular Weight310.44 g/mol
Exact Mass310.19
IUPAC Name9,9-bis(2-methoxyethyl)-2,7-dimethylfluorene
SMILESCOCCC1(CCOC)c2cc(C)ccc2-c2ccc(C)cc21
InChIInChI=1S/C21H26O2/c1-15-5-7-17-18-8-6-16(2)14-20(18)21(9-11-22-3,10-12-23-4)19(17)13-15/h5-8,13-14H,9-12H2,1-4H3
InChIKeyWRCLLZROMIOFKA-UHFFFAOYSA-N
XLogP4.64
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.44
LogP ≤ 54.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9,9-bis(2-methoxyethyl)-2,7-dimethylfluorene?
The IUPAC name of 9,9-bis(2-methoxyethyl)-2,7-dimethylfluorene (CID 58098487) is 9,9-bis(2-methoxyethyl)-2,7-dimethylfluorene.
What is the SMILES notation for 9,9-bis(2-methoxyethyl)-2,7-dimethylfluorene?
The canonical SMILES for 9,9-bis(2-methoxyethyl)-2,7-dimethylfluorene is COCCC1(CCOC)c2cc(C)ccc2-c2ccc(C)cc21.
What is the InChIKey of 9,9-bis(2-methoxyethyl)-2,7-dimethylfluorene?
The InChIKey is WRCLLZROMIOFKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26O2/c1-15-5-7-17-18-8-6-16(2)14-20(18)21(9-11-22-3,10-12-23-4)19(17)13-15/h5-8,13-14H,9-12H2,1-4H3.
What are the key properties of 9,9-bis(2-methoxyethyl)-2,7-dimethylfluorene?
9,9-bis(2-methoxyethyl)-2,7-dimethylfluorene has a molecular weight of 310.44 g/mol, XLogP of 4.64, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-bis(2-methoxyethyl)-2,7-dimethylfluorene is sourced from PubChem (CID 58098487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).