ethane;9-fluoro-2,7,9-trimethylfluorene

C18H21F — CID 142891538

IUPACethane;9-fluoro-2,7,9-trimethylfluorene
SMILESCC.Cc1ccc2c(c1)C(C)(F)c1cc(C)ccc1-2
InChIInChI=1S/C16H15F.C2H6/c1-10-4-6-12-13-7-5-11(2)9-15(13)16(3,17)14(12)8-10;1-2/h4-9H,1-3H3;1-2H3
InChIKeySVAIIZABYBKOHG-UHFFFAOYSA-N
MW256.36 g/mol
LogP5.54
Rot. Bonds

About ethane;9-fluoro-2,7,9-trimethylfluorene

ethane;9-fluoro-2,7,9-trimethylfluorene (PubChem CID 142891538) has the molecular formula C18H21F and a molecular weight of 256.36 g/mol. Its IUPAC name is ethane;9-fluoro-2,7,9-trimethylfluorene.

Molecular Properties

Compound Nameethane;9-fluoro-2,7,9-trimethylfluorene
PubChem CID142891538
Molecular FormulaC18H21F
Molecular Weight256.36 g/mol
Exact Mass256.16
IUPAC Nameethane;9-fluoro-2,7,9-trimethylfluorene
SMILESCC.Cc1ccc2c(c1)C(C)(F)c1cc(C)ccc1-2
InChIInChI=1S/C16H15F.C2H6/c1-10-4-6-12-13-7-5-11(2)9-15(13)16(3,17)14(12)8-10;1-2/h4-9H,1-3H3;1-2H3
InChIKeySVAIIZABYBKOHG-UHFFFAOYSA-N
XLogP5.54
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500256.36
LogP ≤ 55.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

9,9-difluoro-2,7-dimethylfluorene
CID 58776367
2,7,9,9-tetramethylfluorene
CID 22951928
2,6,9,9-tetramethylfluorene
CID 23527438
6,12-diiodo-2,6,8,12-tetramethylindeno[1,2-b]fluorene
CID 129239066
ethane;methane;2,9,9-trimethylfluorene
CID 144920604
2-tert-butyl-9,9-difluoro-7-methylfluorene;ethane
CID 157036733
1,1,6-trimethyl-2,3-dimethylideneindene
CID 145331674
2,2',7'-trimethyl-9,9'-spirobi[fluorene]
CID 20807057
2,7,7'-trimethyl-9,9'-spirobi[fluorene]-2'-amine
CID 58309340
1,1-difluoro-2'-methylspiro[cyclobutane-3,9'-fluorene]
CID 163562486
2',9,9-trimethylspiro[anthracene-10,9'-fluorene]
CID 142504500
2,9,9-trimethyl-7-[3-(7,9,9-trimethylfluoren-2-yl)phenyl]fluorene
CID 58943521

Frequently Asked Questions

What is the IUPAC name of ethane;9-fluoro-2,7,9-trimethylfluorene?
The IUPAC name of ethane;9-fluoro-2,7,9-trimethylfluorene (CID 142891538) is ethane;9-fluoro-2,7,9-trimethylfluorene.
What is the SMILES notation for ethane;9-fluoro-2,7,9-trimethylfluorene?
The canonical SMILES for ethane;9-fluoro-2,7,9-trimethylfluorene is CC.Cc1ccc2c(c1)C(C)(F)c1cc(C)ccc1-2.
What is the InChIKey of ethane;9-fluoro-2,7,9-trimethylfluorene?
The InChIKey is SVAIIZABYBKOHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15F.C2H6/c1-10-4-6-12-13-7-5-11(2)9-15(13)16(3,17)14(12)8-10;1-2/h4-9H,1-3H3;1-2H3.
What are the key properties of ethane;9-fluoro-2,7,9-trimethylfluorene?
ethane;9-fluoro-2,7,9-trimethylfluorene has a molecular weight of 256.36 g/mol, XLogP of 5.54, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;9-fluoro-2,7,9-trimethylfluorene is sourced from PubChem (CID 142891538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).