morpholine;sulfuryl difluoride

C4H9F2NO3S — CID 175173760

IUPACmorpholine;sulfuryl difluoride
SMILESC1COCCN1.O=S(=O)(F)F
InChIInChI=1S/C4H9NO.F2O2S/c1-3-6-4-2-5-1;1-5(2,3)4/h5H,1-4H2;
InChIKeyPXLLMYWWODOGST-UHFFFAOYSA-N
MW189.18 g/mol
LogP-0.22
Rot. Bonds

About morpholine;sulfuryl difluoride

morpholine;sulfuryl difluoride (PubChem CID 175173760) has the molecular formula C4H9F2NO3S and a molecular weight of 189.18 g/mol. Its IUPAC name is morpholine;sulfuryl difluoride.

Molecular Properties

Compound Namemorpholine;sulfuryl difluoride
PubChem CID175173760
Molecular FormulaC4H9F2NO3S
Molecular Weight189.18 g/mol
Exact Mass189.03
IUPAC Namemorpholine;sulfuryl difluoride
SMILESC1COCCN1.O=S(=O)(F)F
InChIInChI=1S/C4H9NO.F2O2S/c1-3-6-4-2-5-1;1-5(2,3)4/h5H,1-4H2;
InChIKeyPXLLMYWWODOGST-UHFFFAOYSA-N
XLogP-0.22
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.18
LogP ≤ 5-0.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze morpholine;sulfuryl difluoride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of morpholine;sulfuryl difluoride?
The IUPAC name of morpholine;sulfuryl difluoride (CID 175173760) is morpholine;sulfuryl difluoride.
What is the SMILES notation for morpholine;sulfuryl difluoride?
The canonical SMILES for morpholine;sulfuryl difluoride is C1COCCN1.O=S(=O)(F)F.
What is the InChIKey of morpholine;sulfuryl difluoride?
The InChIKey is PXLLMYWWODOGST-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NO.F2O2S/c1-3-6-4-2-5-1;1-5(2,3)4/h5H,1-4H2;.
What are the key properties of morpholine;sulfuryl difluoride?
morpholine;sulfuryl difluoride has a molecular weight of 189.18 g/mol, XLogP of -0.22, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for morpholine;sulfuryl difluoride is sourced from PubChem (CID 175173760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).