1-(1-fluoroethenyl)-2-[2-(1-fluoroethenyl)phenoxy]benzene

C16H12F2O — CID 175154392

IUPAC1-(1-fluoroethenyl)-2-[2-(1-fluoroethenyl)phenoxy]benzene
SMILESC=C(F)c1ccccc1Oc1ccccc1C(=C)F
InChIInChI=1S/C16H12F2O/c1-11(17)13-7-3-5-9-15(13)19-16-10-6-4-8-14(16)12(2)18/h3-10H,1-2H2
InChIKeyIUOQODGVWUPCIG-UHFFFAOYSA-N
MW258.27 g/mol
LogP5.36
Rot. Bonds4

About 1-(1-fluoroethenyl)-2-[2-(1-fluoroethenyl)phenoxy]benzene

1-(1-fluoroethenyl)-2-[2-(1-fluoroethenyl)phenoxy]benzene (PubChem CID 175154392) has the molecular formula C16H12F2O and a molecular weight of 258.27 g/mol. Its IUPAC name is 1-(1-fluoroethenyl)-2-[2-(1-fluoroethenyl)phenoxy]benzene.

Molecular Properties

Compound Name1-(1-fluoroethenyl)-2-[2-(1-fluoroethenyl)phenoxy]benzene
PubChem CID175154392
Molecular FormulaC16H12F2O
Molecular Weight258.27 g/mol
Exact Mass258.09
IUPAC Name1-(1-fluoroethenyl)-2-[2-(1-fluoroethenyl)phenoxy]benzene
SMILESC=C(F)c1ccccc1Oc1ccccc1C(=C)F
InChIInChI=1S/C16H12F2O/c1-11(17)13-7-3-5-9-15(13)19-16-10-6-4-8-14(16)12(2)18/h3-10H,1-2H2
InChIKeyIUOQODGVWUPCIG-UHFFFAOYSA-N
XLogP5.36
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500258.27
LogP ≤ 55.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(1-fluoroethenyl)-2-[2-(1-fluoroethenyl)phenoxy]benzene?
The IUPAC name of 1-(1-fluoroethenyl)-2-[2-(1-fluoroethenyl)phenoxy]benzene (CID 175154392) is 1-(1-fluoroethenyl)-2-[2-(1-fluoroethenyl)phenoxy]benzene.
What is the SMILES notation for 1-(1-fluoroethenyl)-2-[2-(1-fluoroethenyl)phenoxy]benzene?
The canonical SMILES for 1-(1-fluoroethenyl)-2-[2-(1-fluoroethenyl)phenoxy]benzene is C=C(F)c1ccccc1Oc1ccccc1C(=C)F.
What is the InChIKey of 1-(1-fluoroethenyl)-2-[2-(1-fluoroethenyl)phenoxy]benzene?
The InChIKey is IUOQODGVWUPCIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12F2O/c1-11(17)13-7-3-5-9-15(13)19-16-10-6-4-8-14(16)12(2)18/h3-10H,1-2H2.
What are the key properties of 1-(1-fluoroethenyl)-2-[2-(1-fluoroethenyl)phenoxy]benzene?
1-(1-fluoroethenyl)-2-[2-(1-fluoroethenyl)phenoxy]benzene has a molecular weight of 258.27 g/mol, XLogP of 5.36, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-fluoroethenyl)-2-[2-(1-fluoroethenyl)phenoxy]benzene is sourced from PubChem (CID 175154392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).