1-fluoro-4-[4-[(E)-2-fluoroethenyl]phenyl]benzene

C14H10F2 — CID 19780903

IUPAC1-fluoro-4-[4-[(E)-2-fluoroethenyl]phenyl]benzene
SMILESF/C=C/c1ccc(-c2ccc(F)cc2)cc1
InChIInChI=1S/C14H10F2/c15-10-9-11-1-3-12(4-2-11)13-5-7-14(16)8-6-13/h1-10H/b10-9+
InChIKeyQHFIXJCTMJDNKA-MDZDMXLPSA-N
MW216.23 g/mol
LogP4.43
Rot. Bonds2

About 1-fluoro-4-[4-[(E)-2-fluoroethenyl]phenyl]benzene

1-fluoro-4-[4-[(E)-2-fluoroethenyl]phenyl]benzene (PubChem CID 19780903) has the molecular formula C14H10F2 and a molecular weight of 216.23 g/mol. Its IUPAC name is 1-fluoro-4-[4-[(E)-2-fluoroethenyl]phenyl]benzene.

Molecular Properties

Compound Name1-fluoro-4-[4-[(E)-2-fluoroethenyl]phenyl]benzene
PubChem CID19780903
Molecular FormulaC14H10F2
Molecular Weight216.23 g/mol
Exact Mass216.08
IUPAC Name1-fluoro-4-[4-[(E)-2-fluoroethenyl]phenyl]benzene
SMILESF/C=C/c1ccc(-c2ccc(F)cc2)cc1
InChIInChI=1S/C14H10F2/c15-10-9-11-1-3-12(4-2-11)13-5-7-14(16)8-6-13/h1-10H/b10-9+
InChIKeyQHFIXJCTMJDNKA-MDZDMXLPSA-N
XLogP4.43
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.23
LogP ≤ 54.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-fluoro-4-[4-[(E)-2-fluoroethenyl]phenyl]benzene?
The IUPAC name of 1-fluoro-4-[4-[(E)-2-fluoroethenyl]phenyl]benzene (CID 19780903) is 1-fluoro-4-[4-[(E)-2-fluoroethenyl]phenyl]benzene.
What is the SMILES notation for 1-fluoro-4-[4-[(E)-2-fluoroethenyl]phenyl]benzene?
The canonical SMILES for 1-fluoro-4-[4-[(E)-2-fluoroethenyl]phenyl]benzene is F/C=C/c1ccc(-c2ccc(F)cc2)cc1.
What is the InChIKey of 1-fluoro-4-[4-[(E)-2-fluoroethenyl]phenyl]benzene?
The InChIKey is QHFIXJCTMJDNKA-MDZDMXLPSA-N. The full InChI is InChI=1S/C14H10F2/c15-10-9-11-1-3-12(4-2-11)13-5-7-14(16)8-6-13/h1-10H/b10-9+.
What are the key properties of 1-fluoro-4-[4-[(E)-2-fluoroethenyl]phenyl]benzene?
1-fluoro-4-[4-[(E)-2-fluoroethenyl]phenyl]benzene has a molecular weight of 216.23 g/mol, XLogP of 4.43, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-4-[4-[(E)-2-fluoroethenyl]phenyl]benzene is sourced from PubChem (CID 19780903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).