cyclobutane-1,3-disulfonyl fluoride

C4H6F2O4S2 — CID 156688465

IUPACcyclobutane-1,3-disulfonyl fluoride
SMILESO=S(=O)(F)C1CC(S(=O)(=O)F)C1
InChIInChI=1S/C4H6F2O4S2/c5-11(7,8)3-1-4(2-3)12(6,9)10/h3-4H,1-2H2
InChIKeyCLECMZJQFCFGKK-UHFFFAOYSA-N
MW220.22 g/mol
LogP0.12
Rot. Bonds2

About cyclobutane-1,3-disulfonyl fluoride

cyclobutane-1,3-disulfonyl fluoride (PubChem CID 156688465) has the molecular formula C4H6F2O4S2 and a molecular weight of 220.22 g/mol. Its IUPAC name is cyclobutane-1,3-disulfonyl fluoride.

Molecular Properties

Compound Namecyclobutane-1,3-disulfonyl fluoride
PubChem CID156688465
Molecular FormulaC4H6F2O4S2
Molecular Weight220.22 g/mol
Exact Mass219.97
IUPAC Namecyclobutane-1,3-disulfonyl fluoride
SMILESO=S(=O)(F)C1CC(S(=O)(=O)F)C1
InChIInChI=1S/C4H6F2O4S2/c5-11(7,8)3-1-4(2-3)12(6,9)10/h3-4H,1-2H2
InChIKeyCLECMZJQFCFGKK-UHFFFAOYSA-N
XLogP0.12
TPSA68.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.22
LogP ≤ 50.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

Propane-1,3-disulfonyl difluoride
CID 13721945
Butane-1,4-disulfonyl difluoride
CID 14384435
Pentane-1,5-disulfonyl difluoride
CID 126970733
Cyclobutanesulfonyl fluoride
CID 22935863
Propane-1,2-disulfonyl fluoride
CID 87247519
Propane-1,2,3-trisulfonyl fluoride
CID 87247796
Butane-1,2,4-trisulfonyl fluoride
CID 87247807
Butane-1,2-disulfonyl fluoride
CID 87247815
Butane-1,2,3-trisulfonyl fluoride
CID 87248016
Butane-1,3-disulfonyl fluoride
CID 87248033
1-Fluorobutane-1,4-disulfonyl fluoride
CID 88180877
Cyclobutane-1,1-disulfonyl fluoride
CID 156688466

Frequently Asked Questions

What is the IUPAC name of cyclobutane-1,3-disulfonyl fluoride?
The IUPAC name of cyclobutane-1,3-disulfonyl fluoride (CID 156688465) is cyclobutane-1,3-disulfonyl fluoride.
What is the SMILES notation for cyclobutane-1,3-disulfonyl fluoride?
The canonical SMILES for cyclobutane-1,3-disulfonyl fluoride is O=S(=O)(F)C1CC(S(=O)(=O)F)C1.
What is the InChIKey of cyclobutane-1,3-disulfonyl fluoride?
The InChIKey is CLECMZJQFCFGKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6F2O4S2/c5-11(7,8)3-1-4(2-3)12(6,9)10/h3-4H,1-2H2.
What are the key properties of cyclobutane-1,3-disulfonyl fluoride?
cyclobutane-1,3-disulfonyl fluoride has a molecular weight of 220.22 g/mol, XLogP of 0.12, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cyclobutane-1,3-disulfonyl fluoride is sourced from PubChem (CID 156688465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).