3-fluoro-2-(3-fluoroprop-1-en-2-ylsulfonyl)prop-1-ene

C6H8F2O2S — CID 175536896

IUPAC3-fluoro-2-(3-fluoroprop-1-en-2-ylsulfonyl)prop-1-ene
SMILESC=C(CF)S(=O)(=O)C(=C)CF
InChIInChI=1S/C6H8F2O2S/c1-5(3-7)11(9,10)6(2)4-8/h1-4H2
InChIKeyXMKRWOFMNLFEDK-UHFFFAOYSA-N
MW182.19 g/mol
LogP1.37
Rot. Bonds4

About 3-fluoro-2-(3-fluoroprop-1-en-2-ylsulfonyl)prop-1-ene

3-fluoro-2-(3-fluoroprop-1-en-2-ylsulfonyl)prop-1-ene (PubChem CID 175536896) has the molecular formula C6H8F2O2S and a molecular weight of 182.19 g/mol. Its IUPAC name is 3-fluoro-2-(3-fluoroprop-1-en-2-ylsulfonyl)prop-1-ene.

Molecular Properties

Compound Name3-fluoro-2-(3-fluoroprop-1-en-2-ylsulfonyl)prop-1-ene
PubChem CID175536896
Molecular FormulaC6H8F2O2S
Molecular Weight182.19 g/mol
Exact Mass182.02
IUPAC Name3-fluoro-2-(3-fluoroprop-1-en-2-ylsulfonyl)prop-1-ene
SMILESC=C(CF)S(=O)(=O)C(=C)CF
InChIInChI=1S/C6H8F2O2S/c1-5(3-7)11(9,10)6(2)4-8/h1-4H2
InChIKeyXMKRWOFMNLFEDK-UHFFFAOYSA-N
XLogP1.37
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.19
LogP ≤ 51.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

carbonic acid;2,3-difluoroprop-1-ene
CID 135262079
prop-2-ene-1,2-disulfonic acid
CID 87689860
3-aminoprop-1-ene-2-sulfonic acid
CID 87311080
2-(fluoromethyl)prop-2-enoate
CID 18790386
2-fluoroprop-2-ene-1-sulfonic acid
CID 87155261
3-fluoro-2-(3-fluoroprop-1-en-2-yloxy)prop-1-ene
CID 23369119
2-(fluoromethyl)prop-2-enoyl 2-(fluoromethyl)prop-2-enoate
CID 154338012
3-(methylsulfonylmethyl)but-3-en-2-one
CID 18731936
1-fluoroethenyl trifluoromethanesulfonate
CID 87156219
ethyl(2-fluoroprop-2-enyl)sulfamic acid
CID 156663415
3,3,3-trifluoro-2-(fluoromethyl)prop-1-ene
CID 20793151
fluoromethanesulfonic acid;methanesulfonic acid
CID 87286738

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-2-(3-fluoroprop-1-en-2-ylsulfonyl)prop-1-ene?
The IUPAC name of 3-fluoro-2-(3-fluoroprop-1-en-2-ylsulfonyl)prop-1-ene (CID 175536896) is 3-fluoro-2-(3-fluoroprop-1-en-2-ylsulfonyl)prop-1-ene.
What is the SMILES notation for 3-fluoro-2-(3-fluoroprop-1-en-2-ylsulfonyl)prop-1-ene?
The canonical SMILES for 3-fluoro-2-(3-fluoroprop-1-en-2-ylsulfonyl)prop-1-ene is C=C(CF)S(=O)(=O)C(=C)CF.
What is the InChIKey of 3-fluoro-2-(3-fluoroprop-1-en-2-ylsulfonyl)prop-1-ene?
The InChIKey is XMKRWOFMNLFEDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8F2O2S/c1-5(3-7)11(9,10)6(2)4-8/h1-4H2.
What are the key properties of 3-fluoro-2-(3-fluoroprop-1-en-2-ylsulfonyl)prop-1-ene?
3-fluoro-2-(3-fluoroprop-1-en-2-ylsulfonyl)prop-1-ene has a molecular weight of 182.19 g/mol, XLogP of 1.37, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-2-(3-fluoroprop-1-en-2-ylsulfonyl)prop-1-ene is sourced from PubChem (CID 175536896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).