(3Z,4Z)-3-benzylidene-4-(5-fluoroinden-1-ylidene)oxolane

C20H15FO — CID 132510234

IUPAC(3Z,4Z)-3-benzylidene-4-(5-fluoroinden-1-ylidene)oxolane
SMILESFc1ccc2c(c1)C=C/C2=C1/COC/C1=C\c1ccccc1
InChIInChI=1S/C20H15FO/c21-17-7-9-18-15(11-17)6-8-19(18)20-13-22-12-16(20)10-14-4-2-1-3-5-14/h1-11H,12-13H2/b16-10+,20-19+
InChIKeyYUYHTTRAAMWXOT-VVKTXGKCSA-N
MW290.34 g/mol
LogP4.72
Rot. Bonds1

About (3Z,4Z)-3-benzylidene-4-(5-fluoroinden-1-ylidene)oxolane

(3Z,4Z)-3-benzylidene-4-(5-fluoroinden-1-ylidene)oxolane (PubChem CID 132510234) has the molecular formula C20H15FO and a molecular weight of 290.34 g/mol. Its IUPAC name is (3Z,4Z)-3-benzylidene-4-(5-fluoroinden-1-ylidene)oxolane.

Molecular Properties

Compound Name(3Z,4Z)-3-benzylidene-4-(5-fluoroinden-1-ylidene)oxolane
PubChem CID132510234
Molecular FormulaC20H15FO
Molecular Weight290.34 g/mol
Exact Mass290.11
IUPAC Name(3Z,4Z)-3-benzylidene-4-(5-fluoroinden-1-ylidene)oxolane
SMILESFc1ccc2c(c1)C=C/C2=C1/COC/C1=C\c1ccccc1
InChIInChI=1S/C20H15FO/c21-17-7-9-18-15(11-17)6-8-19(18)20-13-22-12-16(20)10-14-4-2-1-3-5-14/h1-11H,12-13H2/b16-10+,20-19+
InChIKeyYUYHTTRAAMWXOT-VVKTXGKCSA-N
XLogP4.72
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.34
LogP ≤ 54.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (3Z,4Z)-3-benzylidene-4-(5-fluoroinden-1-ylidene)oxolane?
The IUPAC name of (3Z,4Z)-3-benzylidene-4-(5-fluoroinden-1-ylidene)oxolane (CID 132510234) is (3Z,4Z)-3-benzylidene-4-(5-fluoroinden-1-ylidene)oxolane.
What is the SMILES notation for (3Z,4Z)-3-benzylidene-4-(5-fluoroinden-1-ylidene)oxolane?
The canonical SMILES for (3Z,4Z)-3-benzylidene-4-(5-fluoroinden-1-ylidene)oxolane is Fc1ccc2c(c1)C=C/C2=C1/COC/C1=C\c1ccccc1.
What is the InChIKey of (3Z,4Z)-3-benzylidene-4-(5-fluoroinden-1-ylidene)oxolane?
The InChIKey is YUYHTTRAAMWXOT-VVKTXGKCSA-N. The full InChI is InChI=1S/C20H15FO/c21-17-7-9-18-15(11-17)6-8-19(18)20-13-22-12-16(20)10-14-4-2-1-3-5-14/h1-11H,12-13H2/b16-10+,20-19+.
What are the key properties of (3Z,4Z)-3-benzylidene-4-(5-fluoroinden-1-ylidene)oxolane?
(3Z,4Z)-3-benzylidene-4-(5-fluoroinden-1-ylidene)oxolane has a molecular weight of 290.34 g/mol, XLogP of 4.72, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z,4Z)-3-benzylidene-4-(5-fluoroinden-1-ylidene)oxolane is sourced from PubChem (CID 132510234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).