(E)-1-fluoro-2-methylsulfinylethene

C3H5FOS — CID 87154310

IUPAC(E)-1-fluoro-2-methylsulfinylethene
SMILESCS(=O)/C=C/F
InChIInChI=1S/C3H5FOS/c1-6(5)3-2-4/h2-3H,1H3/b3-2+
InChIKeyASQLIFXILFEOEZ-NSCUHMNNSA-N
MW108.14 g/mol
LogP0.81
Rot. Bonds1

About (E)-1-fluoro-2-methylsulfinylethene

(E)-1-fluoro-2-methylsulfinylethene (PubChem CID 87154310) has the molecular formula C3H5FOS and a molecular weight of 108.14 g/mol. Its IUPAC name is (E)-1-fluoro-2-methylsulfinylethene.

Molecular Properties

Compound Name(E)-1-fluoro-2-methylsulfinylethene
PubChem CID87154310
Molecular FormulaC3H5FOS
Molecular Weight108.14 g/mol
Exact Mass108.00
IUPAC Name(E)-1-fluoro-2-methylsulfinylethene
SMILESCS(=O)/C=C/F
InChIInChI=1S/C3H5FOS/c1-6(5)3-2-4/h2-3H,1H3/b3-2+
InChIKeyASQLIFXILFEOEZ-NSCUHMNNSA-N
XLogP0.81
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500108.14
LogP ≤ 50.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (E)-1-fluoro-2-methylsulfinylethene?
The IUPAC name of (E)-1-fluoro-2-methylsulfinylethene (CID 87154310) is (E)-1-fluoro-2-methylsulfinylethene.
What is the SMILES notation for (E)-1-fluoro-2-methylsulfinylethene?
The canonical SMILES for (E)-1-fluoro-2-methylsulfinylethene is CS(=O)/C=C/F.
What is the InChIKey of (E)-1-fluoro-2-methylsulfinylethene?
The InChIKey is ASQLIFXILFEOEZ-NSCUHMNNSA-N. The full InChI is InChI=1S/C3H5FOS/c1-6(5)3-2-4/h2-3H,1H3/b3-2+.
What are the key properties of (E)-1-fluoro-2-methylsulfinylethene?
(E)-1-fluoro-2-methylsulfinylethene has a molecular weight of 108.14 g/mol, XLogP of 0.81, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-fluoro-2-methylsulfinylethene is sourced from PubChem (CID 87154310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).