1,3-oxazolidine-2-sulfonyl fluoride

C3H6FNO3S — CID 140907686

IUPAC1,3-oxazolidine-2-sulfonyl fluoride
SMILESO=S(=O)(F)C1NCCO1
InChIInChI=1S/C3H6FNO3S/c4-9(6,7)3-5-1-2-8-3/h3,5H,1-2H2
InChIKeyZBQHJCFIHMGOBB-UHFFFAOYSA-N
MW155.15 g/mol
LogP-0.81
Rot. Bonds1

About 1,3-oxazolidine-2-sulfonyl fluoride

1,3-oxazolidine-2-sulfonyl fluoride (PubChem CID 140907686) has the molecular formula C3H6FNO3S and a molecular weight of 155.15 g/mol. Its IUPAC name is 1,3-oxazolidine-2-sulfonyl fluoride.

Molecular Properties

Compound Name1,3-oxazolidine-2-sulfonyl fluoride
PubChem CID140907686
Molecular FormulaC3H6FNO3S
Molecular Weight155.15 g/mol
Exact Mass155.01
IUPAC Name1,3-oxazolidine-2-sulfonyl fluoride
SMILESO=S(=O)(F)C1NCCO1
InChIInChI=1S/C3H6FNO3S/c4-9(6,7)3-5-1-2-8-3/h3,5H,1-2H2
InChIKeyZBQHJCFIHMGOBB-UHFFFAOYSA-N
XLogP-0.81
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.15
LogP ≤ 5-0.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1,3-Oxazolidine-2-sulfinate
CID 66657154
1,3-Oxazolidine-2-sulfonamide
CID 130408284
1,3-Oxazolidine-2-sulfonic acid
CID 150536810
1,3-Oxazolidine-2-sulfinic acid
CID 66657155

Frequently Asked Questions

What is the IUPAC name of 1,3-oxazolidine-2-sulfonyl fluoride?
The IUPAC name of 1,3-oxazolidine-2-sulfonyl fluoride (CID 140907686) is 1,3-oxazolidine-2-sulfonyl fluoride.
What is the SMILES notation for 1,3-oxazolidine-2-sulfonyl fluoride?
The canonical SMILES for 1,3-oxazolidine-2-sulfonyl fluoride is O=S(=O)(F)C1NCCO1.
What is the InChIKey of 1,3-oxazolidine-2-sulfonyl fluoride?
The InChIKey is ZBQHJCFIHMGOBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6FNO3S/c4-9(6,7)3-5-1-2-8-3/h3,5H,1-2H2.
What are the key properties of 1,3-oxazolidine-2-sulfonyl fluoride?
1,3-oxazolidine-2-sulfonyl fluoride has a molecular weight of 155.15 g/mol, XLogP of -0.81, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-oxazolidine-2-sulfonyl fluoride is sourced from PubChem (CID 140907686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).