[(3S)-oxolan-3-yl]methanesulfonyl fluoride

C5H9FO3S — CID 98124119

IUPAC[(3S)-oxolan-3-yl]methanesulfonyl fluoride
SMILESO=S(=O)(F)C[C@H]1CCOC1
InChIInChI=1S/C5H9FO3S/c6-10(7,8)4-5-1-2-9-3-5/h5H,1-4H2/t5-/m0/s1
InChIKeyMYVHNJXPKIQJAF-YFKPBYRVSA-N
MW168.19 g/mol
LogP0.32
Rot. Bonds2

About [(3S)-oxolan-3-yl]methanesulfonyl fluoride

[(3S)-oxolan-3-yl]methanesulfonyl fluoride (PubChem CID 98124119) has the molecular formula C5H9FO3S and a molecular weight of 168.19 g/mol. Its IUPAC name is [(3S)-oxolan-3-yl]methanesulfonyl fluoride.

Molecular Properties

Compound Name[(3S)-oxolan-3-yl]methanesulfonyl fluoride
PubChem CID98124119
Molecular FormulaC5H9FO3S
Molecular Weight168.19 g/mol
Exact Mass168.03
IUPAC Name[(3S)-oxolan-3-yl]methanesulfonyl fluoride
SMILESO=S(=O)(F)C[C@H]1CCOC1
InChIInChI=1S/C5H9FO3S/c6-10(7,8)4-5-1-2-9-3-5/h5H,1-4H2/t5-/m0/s1
InChIKeyMYVHNJXPKIQJAF-YFKPBYRVSA-N
XLogP0.32
TPSA43.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.19
LogP ≤ 50.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [(3S)-oxolan-3-yl]methanesulfonyl fluoride?
The IUPAC name of [(3S)-oxolan-3-yl]methanesulfonyl fluoride (CID 98124119) is [(3S)-oxolan-3-yl]methanesulfonyl fluoride.
What is the SMILES notation for [(3S)-oxolan-3-yl]methanesulfonyl fluoride?
The canonical SMILES for [(3S)-oxolan-3-yl]methanesulfonyl fluoride is O=S(=O)(F)C[C@H]1CCOC1.
What is the InChIKey of [(3S)-oxolan-3-yl]methanesulfonyl fluoride?
The InChIKey is MYVHNJXPKIQJAF-YFKPBYRVSA-N. The full InChI is InChI=1S/C5H9FO3S/c6-10(7,8)4-5-1-2-9-3-5/h5H,1-4H2/t5-/m0/s1.
What are the key properties of [(3S)-oxolan-3-yl]methanesulfonyl fluoride?
[(3S)-oxolan-3-yl]methanesulfonyl fluoride has a molecular weight of 168.19 g/mol, XLogP of 0.32, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3S)-oxolan-3-yl]methanesulfonyl fluoride is sourced from PubChem (CID 98124119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).