3-methylbut-2-en-2-yl thiohypofluorite

C5H9FS — CID 138655385

IUPAC3-methylbut-2-en-2-yl thiohypofluorite
SMILESCC(C)=C(C)SF
InChIInChI=1S/C5H9FS/c1-4(2)5(3)7-6/h1-3H3
InChIKeyIMAUBLPXGDSRDR-UHFFFAOYSA-N
MW120.19 g/mol
LogP2.92
Rot. Bonds1

About 3-methylbut-2-en-2-yl thiohypofluorite

3-methylbut-2-en-2-yl thiohypofluorite (PubChem CID 138655385) has the molecular formula C5H9FS and a molecular weight of 120.19 g/mol. Its IUPAC name is 3-methylbut-2-en-2-yl thiohypofluorite.

Molecular Properties

Compound Name3-methylbut-2-en-2-yl thiohypofluorite
PubChem CID138655385
Molecular FormulaC5H9FS
Molecular Weight120.19 g/mol
Exact Mass120.04
IUPAC Name3-methylbut-2-en-2-yl thiohypofluorite
SMILESCC(C)=C(C)SF
InChIInChI=1S/C5H9FS/c1-4(2)5(3)7-6/h1-3H3
InChIKeyIMAUBLPXGDSRDR-UHFFFAOYSA-N
XLogP2.92
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.19
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(3-methylbut-2-en-2-ylsulfanyl)propan-2-one
CID 12859457
N-(3-methylbut-2-en-2-ylsulfanyl)methanimine
CID 178007054
3-methylbut-2-en-2-ylsulfanyl(silyl)silane
CID 174959720
3-methylbut-2-ene-2-thiol
CID 19937202
bis(2,3-dimethylbut-2-ene);methane
CID 162234102
2,3-dimethylbut-2-ene;phosphane
CID 159112773
1-fluoro-1-iodo-2-methylprop-1-ene
CID 118348659
[(3E,5Z)-5-methylhepta-1,3,5-trien-3-yl] thiohypofluorite
CID 143818483
6-acetyloxyhexyl 2,2-difluoro-2-fluorosulfanylacetate
CID 142342576
(E)-2,3-difluorobut-2-ene
CID 59928419
2,3,8,9-tetramethyldeca-2,8-diene
CID 14968821
actinium;3-methylbut-2-en-2-ol
CID 22892781

Frequently Asked Questions

What is the IUPAC name of 3-methylbut-2-en-2-yl thiohypofluorite?
The IUPAC name of 3-methylbut-2-en-2-yl thiohypofluorite (CID 138655385) is 3-methylbut-2-en-2-yl thiohypofluorite.
What is the SMILES notation for 3-methylbut-2-en-2-yl thiohypofluorite?
The canonical SMILES for 3-methylbut-2-en-2-yl thiohypofluorite is CC(C)=C(C)SF.
What is the InChIKey of 3-methylbut-2-en-2-yl thiohypofluorite?
The InChIKey is IMAUBLPXGDSRDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9FS/c1-4(2)5(3)7-6/h1-3H3.
What are the key properties of 3-methylbut-2-en-2-yl thiohypofluorite?
3-methylbut-2-en-2-yl thiohypofluorite has a molecular weight of 120.19 g/mol, XLogP of 2.92, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylbut-2-en-2-yl thiohypofluorite is sourced from PubChem (CID 138655385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).