butan-2-yl thiohypofluorite

C4H9FS — CID 143749976

IUPACbutan-2-yl thiohypofluorite
SMILESCCC(C)SF
InChIInChI=1S/C4H9FS/c1-3-4(2)6-5/h4H,3H2,1-2H3
InChIKeyUWIBHJWCYMPMJF-UHFFFAOYSA-N
MW108.18 g/mol
LogP2.40
Rot. Bonds2

About butan-2-yl thiohypofluorite

butan-2-yl thiohypofluorite (PubChem CID 143749976) has the molecular formula C4H9FS and a molecular weight of 108.18 g/mol. Its IUPAC name is butan-2-yl thiohypofluorite.

Molecular Properties

Compound Namebutan-2-yl thiohypofluorite
PubChem CID143749976
Molecular FormulaC4H9FS
Molecular Weight108.18 g/mol
Exact Mass108.04
IUPAC Namebutan-2-yl thiohypofluorite
SMILESCCC(C)SF
InChIInChI=1S/C4H9FS/c1-3-4(2)6-5/h4H,3H2,1-2H3
InChIKeyUWIBHJWCYMPMJF-UHFFFAOYSA-N
XLogP2.40
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500108.18
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

n-Butyl mercaptide
CID 193565
n-Butyl sulfonium fluoride
CID 118977569
Hexyl thiohypofluorite
CID 59067997
Pentyl thiohypofluorite
CID 87665741
Trifluoro(pentyl)-lambda4-sulfane
CID 87899636
CID 89409968
CID 89409968
Butyl-fluoro-sulfanylidene-lambda4-sulfane
CID 90277188
[(2R)-butan-2-yl] thiohypofluorite
CID 122692134
Butan-2-yl(trifluoro)-lambda4-sulfane
CID 137504764
Propyl thiohypofluorite
CID 141780208
Propan-2-yl thiohypofluorite
CID 142291580
Fluoro-dimethyl-propan-2-yl-lambda4-sulfane
CID 146369406

Frequently Asked Questions

What is the IUPAC name of butan-2-yl thiohypofluorite?
The IUPAC name of butan-2-yl thiohypofluorite (CID 143749976) is butan-2-yl thiohypofluorite.
What is the SMILES notation for butan-2-yl thiohypofluorite?
The canonical SMILES for butan-2-yl thiohypofluorite is CCC(C)SF.
What is the InChIKey of butan-2-yl thiohypofluorite?
The InChIKey is UWIBHJWCYMPMJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9FS/c1-3-4(2)6-5/h4H,3H2,1-2H3.
What are the key properties of butan-2-yl thiohypofluorite?
butan-2-yl thiohypofluorite has a molecular weight of 108.18 g/mol, XLogP of 2.40, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for butan-2-yl thiohypofluorite is sourced from PubChem (CID 143749976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).