[2-fluoro-2-(1-fluoro-2-phenylethenyl)sulfinylethenyl]benzene

C16H12F2OS — CID 68923226

IUPAC[2-fluoro-2-(1-fluoro-2-phenylethenyl)sulfinylethenyl]benzene
SMILESO=S(C(F)=Cc1ccccc1)C(F)=Cc1ccccc1
InChIInChI=1S/C16H12F2OS/c17-15(11-13-7-3-1-4-8-13)20(19)16(18)12-14-9-5-2-6-10-14/h1-12H
InChIKeyQDOPQGXVSZROQE-UHFFFAOYSA-N
MW290.33 g/mol
LogP4.67
Rot. Bonds4

About [2-fluoro-2-(1-fluoro-2-phenylethenyl)sulfinylethenyl]benzene

[2-fluoro-2-(1-fluoro-2-phenylethenyl)sulfinylethenyl]benzene (PubChem CID 68923226) has the molecular formula C16H12F2OS and a molecular weight of 290.33 g/mol. Its IUPAC name is [2-fluoro-2-(1-fluoro-2-phenylethenyl)sulfinylethenyl]benzene.

Molecular Properties

Compound Name[2-fluoro-2-(1-fluoro-2-phenylethenyl)sulfinylethenyl]benzene
PubChem CID68923226
Molecular FormulaC16H12F2OS
Molecular Weight290.33 g/mol
Exact Mass290.06
IUPAC Name[2-fluoro-2-(1-fluoro-2-phenylethenyl)sulfinylethenyl]benzene
SMILESO=S(C(F)=Cc1ccccc1)C(F)=Cc1ccccc1
InChIInChI=1S/C16H12F2OS/c17-15(11-13-7-3-1-4-8-13)20(19)16(18)12-14-9-5-2-6-10-14/h1-12H
InChIKeyQDOPQGXVSZROQE-UHFFFAOYSA-N
XLogP4.67
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.33
LogP ≤ 54.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze [2-fluoro-2-(1-fluoro-2-phenylethenyl)sulfinylethenyl]benzene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(E)-2-fluoro-3-phenylprop-2-enoate
CID 20564685
[(E)-2-fluoro-2-iodoethenyl]benzene
CID 11492511
2-fluoro-3-phenylprop-2-enal
CID 54285949
CID 11750295
CID 11750295
1-[(R)-[(E)-1-fluoro-2-(4-phenylphenyl)ethenyl]sulfinyl]-4-methylbenzene
CID 11914677
[2-fluoro-2-(1-fluoro-2-phenylethenyl)sulfanylethenyl]benzene
CID 66730141
2,2-difluoroethenylbenzene;1,1-difluoroprop-1-ene
CID 90783714
(Z)-3-phenyl-2-sulfanylprop-2-enoic acid
CID 5396334
[(Z)-2-(benzenesulfonyl)-2-fluoroethenyl]benzene
CID 134986797
[(1E)-3-fluoro-2-methylbuta-1,3-dienyl]benzene
CID 12586000
2,2-dibromo(113C)ethenylbenzene
CID 131856077
3-fluoro-1-phenylprop-1-en-2-ol
CID 172850528

Frequently Asked Questions

What is the IUPAC name of [2-fluoro-2-(1-fluoro-2-phenylethenyl)sulfinylethenyl]benzene?
The IUPAC name of [2-fluoro-2-(1-fluoro-2-phenylethenyl)sulfinylethenyl]benzene (CID 68923226) is [2-fluoro-2-(1-fluoro-2-phenylethenyl)sulfinylethenyl]benzene.
What is the SMILES notation for [2-fluoro-2-(1-fluoro-2-phenylethenyl)sulfinylethenyl]benzene?
The canonical SMILES for [2-fluoro-2-(1-fluoro-2-phenylethenyl)sulfinylethenyl]benzene is O=S(C(F)=Cc1ccccc1)C(F)=Cc1ccccc1.
What is the InChIKey of [2-fluoro-2-(1-fluoro-2-phenylethenyl)sulfinylethenyl]benzene?
The InChIKey is QDOPQGXVSZROQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12F2OS/c17-15(11-13-7-3-1-4-8-13)20(19)16(18)12-14-9-5-2-6-10-14/h1-12H.
What are the key properties of [2-fluoro-2-(1-fluoro-2-phenylethenyl)sulfinylethenyl]benzene?
[2-fluoro-2-(1-fluoro-2-phenylethenyl)sulfinylethenyl]benzene has a molecular weight of 290.33 g/mol, XLogP of 4.67, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2-fluoro-2-(1-fluoro-2-phenylethenyl)sulfinylethenyl]benzene is sourced from PubChem (CID 68923226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).