9-(2,5-dimethylphenyl)-9H-fluorene

C21H18 — CID 10730779

IUPAC9-(2,5-dimethylphenyl)-9H-fluorene
SMILESCc1ccc(C)c(C2c3ccccc3-c3ccccc32)c1
InChIInChI=1S/C21H18/c1-14-11-12-15(2)20(13-14)21-18-9-5-3-7-16(18)17-8-4-6-10-19(17)21/h3-13,21H,1-2H3
InChIKeyIAMGZQVBSSCMLP-UHFFFAOYSA-N
MW270.38 g/mol
LogP5.46
Rot. Bonds1

About 9-(2,5-dimethylphenyl)-9H-fluorene

9-(2,5-dimethylphenyl)-9H-fluorene (PubChem CID 10730779) has the molecular formula C21H18 and a molecular weight of 270.38 g/mol. Its IUPAC name is 9-(2,5-dimethylphenyl)-9H-fluorene.

Molecular Properties

Compound Name9-(2,5-dimethylphenyl)-9H-fluorene
PubChem CID10730779
Molecular FormulaC21H18
Molecular Weight270.38 g/mol
Exact Mass270.14
IUPAC Name9-(2,5-dimethylphenyl)-9H-fluorene
SMILESCc1ccc(C)c(C2c3ccccc3-c3ccccc32)c1
InChIInChI=1S/C21H18/c1-14-11-12-15(2)20(13-14)21-18-9-5-3-7-16(18)17-8-4-6-10-19(17)21/h3-13,21H,1-2H3
InChIKeyIAMGZQVBSSCMLP-UHFFFAOYSA-N
XLogP5.46
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500270.38
LogP ≤ 55.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 9-(2,5-dimethylphenyl)-9H-fluorene?
The IUPAC name of 9-(2,5-dimethylphenyl)-9H-fluorene (CID 10730779) is 9-(2,5-dimethylphenyl)-9H-fluorene.
What is the SMILES notation for 9-(2,5-dimethylphenyl)-9H-fluorene?
The canonical SMILES for 9-(2,5-dimethylphenyl)-9H-fluorene is Cc1ccc(C)c(C2c3ccccc3-c3ccccc32)c1.
What is the InChIKey of 9-(2,5-dimethylphenyl)-9H-fluorene?
The InChIKey is IAMGZQVBSSCMLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18/c1-14-11-12-15(2)20(13-14)21-18-9-5-3-7-16(18)17-8-4-6-10-19(17)21/h3-13,21H,1-2H3.
What are the key properties of 9-(2,5-dimethylphenyl)-9H-fluorene?
9-(2,5-dimethylphenyl)-9H-fluorene has a molecular weight of 270.38 g/mol, XLogP of 5.46, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(2,5-dimethylphenyl)-9H-fluorene is sourced from PubChem (CID 10730779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).