(E)-3-fluoro-1-methylsulfonylpent-2-ene

C6H11FO2S — CID 143311068

IUPAC(E)-3-fluoro-1-methylsulfonylpent-2-ene
SMILESCC/C(F)=C\CS(C)(=O)=O
InChIInChI=1S/C6H11FO2S/c1-3-6(7)4-5-10(2,8)9/h4H,3,5H2,1-2H3/b6-4+
InChIKeyLAKUCOFQMXQZAA-GQCTYLIASA-N
MW166.22 g/mol
LogP1.29
Rot. Bonds3

About (E)-3-fluoro-1-methylsulfonylpent-2-ene

(E)-3-fluoro-1-methylsulfonylpent-2-ene (PubChem CID 143311068) has the molecular formula C6H11FO2S and a molecular weight of 166.22 g/mol. Its IUPAC name is (E)-3-fluoro-1-methylsulfonylpent-2-ene.

Molecular Properties

Compound Name(E)-3-fluoro-1-methylsulfonylpent-2-ene
PubChem CID143311068
Molecular FormulaC6H11FO2S
Molecular Weight166.22 g/mol
Exact Mass166.05
IUPAC Name(E)-3-fluoro-1-methylsulfonylpent-2-ene
SMILESCC/C(F)=C\CS(C)(=O)=O
InChIInChI=1S/C6H11FO2S/c1-3-6(7)4-5-10(2,8)9/h4H,3,5H2,1-2H3/b6-4+
InChIKeyLAKUCOFQMXQZAA-GQCTYLIASA-N
XLogP1.29
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 51.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(Z)-3-methyl-1-methylsulfonylpent-2-ene
CID 143970798
(E)-1-chloro-2-methyl-4-methylsulfonylbut-2-ene
CID 12572206
(2Z,5E)-6-fluoroocta-2,5-diene
CID 142845543
butan-2-one;ethane;1-methylsulfonylethane;propane
CID 159716961
1-fluoro-3-methylsulfonylprop-1-ene
CID 173170471
(Z,4S)-4-hydroxy-5-methyl-7-methylsulfonylhept-5-en-2-one
CID 101123113
(Z)-N,N-diethyl-2-fluoro-4-(4-methylphenyl)sulfonylbut-2-en-1-amine
CID 102177219
CID 169428164
CID 169428164
sodium (Z)-2-fluorobut-1-en-1-olate
CID 140663889
(2-methylsulfonylacetyl) 2-methylsulfonylacetate
CID 54337400
(3E)-4-fluorohexa-1,3-diene
CID 88586520
2,3-dimethyl-4-methylsulfonylbut-1-ene;3-methanidyl-2-methylbut-1-ene;3-methyl-1-methylsulfonylpent-2-ene;3-methylpent-2-ene;bis(yttrium)
CID 159513651

Frequently Asked Questions

What is the IUPAC name of (E)-3-fluoro-1-methylsulfonylpent-2-ene?
The IUPAC name of (E)-3-fluoro-1-methylsulfonylpent-2-ene (CID 143311068) is (E)-3-fluoro-1-methylsulfonylpent-2-ene.
What is the SMILES notation for (E)-3-fluoro-1-methylsulfonylpent-2-ene?
The canonical SMILES for (E)-3-fluoro-1-methylsulfonylpent-2-ene is CC/C(F)=C\CS(C)(=O)=O.
What is the InChIKey of (E)-3-fluoro-1-methylsulfonylpent-2-ene?
The InChIKey is LAKUCOFQMXQZAA-GQCTYLIASA-N. The full InChI is InChI=1S/C6H11FO2S/c1-3-6(7)4-5-10(2,8)9/h4H,3,5H2,1-2H3/b6-4+.
What are the key properties of (E)-3-fluoro-1-methylsulfonylpent-2-ene?
(E)-3-fluoro-1-methylsulfonylpent-2-ene has a molecular weight of 166.22 g/mol, XLogP of 1.29, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-fluoro-1-methylsulfonylpent-2-ene is sourced from PubChem (CID 143311068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).