(4Z)-4-benzylidene-6-(trifluoromethyl)-6H-thieno[2,3-c]furan

C14H9F3OS — CID 135042319

IUPAC(4Z)-4-benzylidene-6-(trifluoromethyl)-6H-thieno[2,3-c]furan
SMILESFC(F)(F)C1O/C(=C\c2ccccc2)c2ccsc21
InChIInChI=1S/C14H9F3OS/c15-14(16,17)13-12-10(6-7-19-12)11(18-13)8-9-4-2-1-3-5-9/h1-8,13H/b11-8-
InChIKeyZKSOOYZLVFVVKW-FLIBITNWSA-N
MW282.29 g/mol
LogP4.88
Rot. Bonds1

About (4Z)-4-benzylidene-6-(trifluoromethyl)-6H-thieno[2,3-c]furan

(4Z)-4-benzylidene-6-(trifluoromethyl)-6H-thieno[2,3-c]furan (PubChem CID 135042319) has the molecular formula C14H9F3OS and a molecular weight of 282.29 g/mol. Its IUPAC name is (4Z)-4-benzylidene-6-(trifluoromethyl)-6H-thieno[2,3-c]furan.

Molecular Properties

Compound Name(4Z)-4-benzylidene-6-(trifluoromethyl)-6H-thieno[2,3-c]furan
PubChem CID135042319
Molecular FormulaC14H9F3OS
Molecular Weight282.29 g/mol
Exact Mass282.03
IUPAC Name(4Z)-4-benzylidene-6-(trifluoromethyl)-6H-thieno[2,3-c]furan
SMILESFC(F)(F)C1O/C(=C\c2ccccc2)c2ccsc21
InChIInChI=1S/C14H9F3OS/c15-14(16,17)13-12-10(6-7-19-12)11(18-13)8-9-4-2-1-3-5-9/h1-8,13H/b11-8-
InChIKeyZKSOOYZLVFVVKW-FLIBITNWSA-N
XLogP4.88
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.29
LogP ≤ 54.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4Z)-4-benzylidene-6-(trifluoromethyl)-6H-thieno[2,3-c]furan?
The IUPAC name of (4Z)-4-benzylidene-6-(trifluoromethyl)-6H-thieno[2,3-c]furan (CID 135042319) is (4Z)-4-benzylidene-6-(trifluoromethyl)-6H-thieno[2,3-c]furan.
What is the SMILES notation for (4Z)-4-benzylidene-6-(trifluoromethyl)-6H-thieno[2,3-c]furan?
The canonical SMILES for (4Z)-4-benzylidene-6-(trifluoromethyl)-6H-thieno[2,3-c]furan is FC(F)(F)C1O/C(=C\c2ccccc2)c2ccsc21.
What is the InChIKey of (4Z)-4-benzylidene-6-(trifluoromethyl)-6H-thieno[2,3-c]furan?
The InChIKey is ZKSOOYZLVFVVKW-FLIBITNWSA-N. The full InChI is InChI=1S/C14H9F3OS/c15-14(16,17)13-12-10(6-7-19-12)11(18-13)8-9-4-2-1-3-5-9/h1-8,13H/b11-8-.
What are the key properties of (4Z)-4-benzylidene-6-(trifluoromethyl)-6H-thieno[2,3-c]furan?
(4Z)-4-benzylidene-6-(trifluoromethyl)-6H-thieno[2,3-c]furan has a molecular weight of 282.29 g/mol, XLogP of 4.88, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z)-4-benzylidene-6-(trifluoromethyl)-6H-thieno[2,3-c]furan is sourced from PubChem (CID 135042319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).