2-thiophen-3-yl-9-(trifluoromethyl)fluoren-9-ol

C18H11F3OS — CID 59492862

IUPAC2-thiophen-3-yl-9-(trifluoromethyl)fluoren-9-ol
SMILESOC1(C(F)(F)F)c2ccccc2-c2ccc(-c3ccsc3)cc21
InChIInChI=1S/C18H11F3OS/c19-18(20,21)17(22)15-4-2-1-3-13(15)14-6-5-11(9-16(14)17)12-7-8-23-10-12/h1-10,22H
InChIKeyFHFWAGNKGYKNLG-UHFFFAOYSA-N
MW332.35 g/mol
LogP5.19
Rot. Bonds1

About 2-thiophen-3-yl-9-(trifluoromethyl)fluoren-9-ol

2-thiophen-3-yl-9-(trifluoromethyl)fluoren-9-ol (PubChem CID 59492862) has the molecular formula C18H11F3OS and a molecular weight of 332.35 g/mol. Its IUPAC name is 2-thiophen-3-yl-9-(trifluoromethyl)fluoren-9-ol.

Molecular Properties

Compound Name2-thiophen-3-yl-9-(trifluoromethyl)fluoren-9-ol
PubChem CID59492862
Molecular FormulaC18H11F3OS
Molecular Weight332.35 g/mol
Exact Mass332.05
IUPAC Name2-thiophen-3-yl-9-(trifluoromethyl)fluoren-9-ol
SMILESOC1(C(F)(F)F)c2ccccc2-c2ccc(-c3ccsc3)cc21
InChIInChI=1S/C18H11F3OS/c19-18(20,21)17(22)15-4-2-1-3-13(15)14-6-5-11(9-16(14)17)12-7-8-23-10-12/h1-10,22H
InChIKeyFHFWAGNKGYKNLG-UHFFFAOYSA-N
XLogP5.19
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500332.35
LogP ≤ 55.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-thiophen-3-yl-9-(trifluoromethyl)fluoren-9-ol?
The IUPAC name of 2-thiophen-3-yl-9-(trifluoromethyl)fluoren-9-ol (CID 59492862) is 2-thiophen-3-yl-9-(trifluoromethyl)fluoren-9-ol.
What is the SMILES notation for 2-thiophen-3-yl-9-(trifluoromethyl)fluoren-9-ol?
The canonical SMILES for 2-thiophen-3-yl-9-(trifluoromethyl)fluoren-9-ol is OC1(C(F)(F)F)c2ccccc2-c2ccc(-c3ccsc3)cc21.
What is the InChIKey of 2-thiophen-3-yl-9-(trifluoromethyl)fluoren-9-ol?
The InChIKey is FHFWAGNKGYKNLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H11F3OS/c19-18(20,21)17(22)15-4-2-1-3-13(15)14-6-5-11(9-16(14)17)12-7-8-23-10-12/h1-10,22H.
What are the key properties of 2-thiophen-3-yl-9-(trifluoromethyl)fluoren-9-ol?
2-thiophen-3-yl-9-(trifluoromethyl)fluoren-9-ol has a molecular weight of 332.35 g/mol, XLogP of 5.19, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-thiophen-3-yl-9-(trifluoromethyl)fluoren-9-ol is sourced from PubChem (CID 59492862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).