thiophene-2,4-disulfonyl fluoride

C4H2F2O4S3 — CID 18930945

IUPACthiophene-2,4-disulfonyl fluoride
SMILESO=S(=O)(F)c1csc(S(=O)(=O)F)c1
InChIInChI=1S/C4H2F2O4S3/c5-12(7,8)3-1-4(11-2-3)13(6,9)10/h1-2H
InChIKeyBNMUOVYBOLOOCZ-UHFFFAOYSA-N
MW248.25 g/mol
LogP1.06
Rot. Bonds2

About thiophene-2,4-disulfonyl fluoride

thiophene-2,4-disulfonyl fluoride (PubChem CID 18930945) has the molecular formula C4H2F2O4S3 and a molecular weight of 248.25 g/mol. Its IUPAC name is thiophene-2,4-disulfonyl fluoride.

Molecular Properties

Compound Namethiophene-2,4-disulfonyl fluoride
PubChem CID18930945
Molecular FormulaC4H2F2O4S3
Molecular Weight248.25 g/mol
Exact Mass247.91
IUPAC Namethiophene-2,4-disulfonyl fluoride
SMILESO=S(=O)(F)c1csc(S(=O)(=O)F)c1
InChIInChI=1S/C4H2F2O4S3/c5-12(7,8)3-1-4(11-2-3)13(6,9)10/h1-2H
InChIKeyBNMUOVYBOLOOCZ-UHFFFAOYSA-N
XLogP1.06
TPSA68.28 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.25
LogP ≤ 51.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-Thiophenesulfonyl chloride
CID 85518
3-(Methylsulfonyl)thiophene
CID 248648
2-Methylsulfonylthiophene
CID 707933
2,4-Thiophenedisulfonamide
CID 211062
Thiophene-3-sulfonyl Chloride
CID 2776378
Thiophene-2-sulfonyl fluoride
CID 19098976
Sodium thiophene-2-sulfinate
CID 23674657
2,5-Bis(ethylsulfonyl)thiophene
CID 678404
Thiophene-2-sulfonic acid
CID 165170
2-Thiophenesulfonic acid, sodium salt
CID 23673643
3-Fluorothiophene-2-sulfonyl chloride
CID 15158653
2-((Trifluoromethyl)sulfonyl)thiophene
CID 12288221

Frequently Asked Questions

What is the IUPAC name of thiophene-2,4-disulfonyl fluoride?
The IUPAC name of thiophene-2,4-disulfonyl fluoride (CID 18930945) is thiophene-2,4-disulfonyl fluoride.
What is the SMILES notation for thiophene-2,4-disulfonyl fluoride?
The canonical SMILES for thiophene-2,4-disulfonyl fluoride is O=S(=O)(F)c1csc(S(=O)(=O)F)c1.
What is the InChIKey of thiophene-2,4-disulfonyl fluoride?
The InChIKey is BNMUOVYBOLOOCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H2F2O4S3/c5-12(7,8)3-1-4(11-2-3)13(6,9)10/h1-2H.
What are the key properties of thiophene-2,4-disulfonyl fluoride?
thiophene-2,4-disulfonyl fluoride has a molecular weight of 248.25 g/mol, XLogP of 1.06, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for thiophene-2,4-disulfonyl fluoride is sourced from PubChem (CID 18930945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).