3-fluoro-9,9-dimethylfluorene

C15H13F — CID 130217991

IUPAC3-fluoro-9,9-dimethylfluorene
SMILESCC1(C)c2ccccc2-c2cc(F)ccc21
InChIInChI=1S/C15H13F/c1-15(2)13-6-4-3-5-11(13)12-9-10(16)7-8-14(12)15/h3-9H,1-2H3
InChIKeyMNIKAGYIZDDBQY-UHFFFAOYSA-N
MW212.27 g/mol
LogP4.13
Rot. Bonds

About 3-fluoro-9,9-dimethylfluorene

3-fluoro-9,9-dimethylfluorene (PubChem CID 130217991) has the molecular formula C15H13F and a molecular weight of 212.27 g/mol. Its IUPAC name is 3-fluoro-9,9-dimethylfluorene.

Molecular Properties

Compound Name3-fluoro-9,9-dimethylfluorene
PubChem CID130217991
Molecular FormulaC15H13F
Molecular Weight212.27 g/mol
Exact Mass212.10
IUPAC Name3-fluoro-9,9-dimethylfluorene
SMILESCC1(C)c2ccccc2-c2cc(F)ccc21
InChIInChI=1S/C15H13F/c1-15(2)13-6-4-3-5-11(13)12-9-10(16)7-8-14(12)15/h3-9H,1-2H3
InChIKeyMNIKAGYIZDDBQY-UHFFFAOYSA-N
XLogP4.13
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.27
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-9,9-dimethylfluorene?
The IUPAC name of 3-fluoro-9,9-dimethylfluorene (CID 130217991) is 3-fluoro-9,9-dimethylfluorene.
What is the SMILES notation for 3-fluoro-9,9-dimethylfluorene?
The canonical SMILES for 3-fluoro-9,9-dimethylfluorene is CC1(C)c2ccccc2-c2cc(F)ccc21.
What is the InChIKey of 3-fluoro-9,9-dimethylfluorene?
The InChIKey is MNIKAGYIZDDBQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F/c1-15(2)13-6-4-3-5-11(13)12-9-10(16)7-8-14(12)15/h3-9H,1-2H3.
What are the key properties of 3-fluoro-9,9-dimethylfluorene?
3-fluoro-9,9-dimethylfluorene has a molecular weight of 212.27 g/mol, XLogP of 4.13, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-9,9-dimethylfluorene is sourced from PubChem (CID 130217991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).