ethane;7-fluoro-1,1,5-trimethylindene

C14H19F — CID 156894039

IUPACethane;7-fluoro-1,1,5-trimethylindene
SMILESCC.Cc1cc(F)c2c(c1)C=CC2(C)C
InChIInChI=1S/C12H13F.C2H6/c1-8-6-9-4-5-12(2,3)11(9)10(13)7-8;1-2/h4-7H,1-3H3;1-2H3
InChIKeyDTKFERDZOUOFNP-UHFFFAOYSA-N
MW206.30 g/mol
LogP4.46
Rot. Bonds

About ethane;7-fluoro-1,1,5-trimethylindene

ethane;7-fluoro-1,1,5-trimethylindene (PubChem CID 156894039) has the molecular formula C14H19F and a molecular weight of 206.30 g/mol. Its IUPAC name is ethane;7-fluoro-1,1,5-trimethylindene.

Molecular Properties

Compound Nameethane;7-fluoro-1,1,5-trimethylindene
PubChem CID156894039
Molecular FormulaC14H19F
Molecular Weight206.30 g/mol
Exact Mass206.15
IUPAC Nameethane;7-fluoro-1,1,5-trimethylindene
SMILESCC.Cc1cc(F)c2c(c1)C=CC2(C)C
InChIInChI=1S/C12H13F.C2H6/c1-8-6-9-4-5-12(2,3)11(9)10(13)7-8;1-2/h4-7H,1-3H3;1-2H3
InChIKeyDTKFERDZOUOFNP-UHFFFAOYSA-N
XLogP4.46
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.30
LogP ≤ 54.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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2,6-difluoro-4-methylphenol;rutherfordium
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2,2,7-trimethylnaphthalen-1-one
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Frequently Asked Questions

What is the IUPAC name of ethane;7-fluoro-1,1,5-trimethylindene?
The IUPAC name of ethane;7-fluoro-1,1,5-trimethylindene (CID 156894039) is ethane;7-fluoro-1,1,5-trimethylindene.
What is the SMILES notation for ethane;7-fluoro-1,1,5-trimethylindene?
The canonical SMILES for ethane;7-fluoro-1,1,5-trimethylindene is CC.Cc1cc(F)c2c(c1)C=CC2(C)C.
What is the InChIKey of ethane;7-fluoro-1,1,5-trimethylindene?
The InChIKey is DTKFERDZOUOFNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13F.C2H6/c1-8-6-9-4-5-12(2,3)11(9)10(13)7-8;1-2/h4-7H,1-3H3;1-2H3.
What are the key properties of ethane;7-fluoro-1,1,5-trimethylindene?
ethane;7-fluoro-1,1,5-trimethylindene has a molecular weight of 206.30 g/mol, XLogP of 4.46, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;7-fluoro-1,1,5-trimethylindene is sourced from PubChem (CID 156894039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).