5-ethylfuran-2-sulfonyl chloride

C6H7ClO3S — CID 119084512

IUPAC5-ethylfuran-2-sulfonyl chloride
SMILESCCc1ccc(S(=O)(=O)Cl)o1
InChIInChI=1S/C6H7ClO3S/c1-2-5-3-4-6(10-5)11(7,8)9/h3-4H,2H2,1H3
InChIKeyIKKZOQBZEXWPLL-UHFFFAOYSA-N
MW194.64 g/mol
LogP1.77
Rot. Bonds2

About 5-ethylfuran-2-sulfonyl chloride

5-ethylfuran-2-sulfonyl chloride (PubChem CID 119084512) has the molecular formula C6H7ClO3S and a molecular weight of 194.64 g/mol. Its IUPAC name is 5-ethylfuran-2-sulfonyl chloride.

Molecular Properties

Compound Name5-ethylfuran-2-sulfonyl chloride
PubChem CID119084512
Molecular FormulaC6H7ClO3S
Molecular Weight194.64 g/mol
Exact Mass193.98
IUPAC Name5-ethylfuran-2-sulfonyl chloride
SMILESCCc1ccc(S(=O)(=O)Cl)o1
InChIInChI=1S/C6H7ClO3S/c1-2-5-3-4-6(10-5)11(7,8)9/h3-4H,2H2,1H3
InChIKeyIKKZOQBZEXWPLL-UHFFFAOYSA-N
XLogP1.77
TPSA47.28 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.64
LogP ≤ 51.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-Ethyl-5-methylfuran
CID 74346
2-Methyl-5-(methylthio)furan
CID 61657
2,5-Dimethyl-3-furanthiol
CID 41569
2,5-Dimethyl-3-(methyldithio)furan
CID 20313888
Cimlanod
CID 76685198
5-Methylfuran-2-sulfonamide
CID 11423751
2-Furanthiol, 5-methyl-
CID 143754
2,5-Dimethylfuran-3-sulfonamide
CID 57575205
2,5-dimethylfuran-3-sulfonyl Chloride
CID 2795024
5-Methylfuran-2-sulfonyl chloride
CID 17864361
5-Cyano-2-furansulfonyl chloride
CID 55279351
2-Methylfuran-3-sulfonyl chloride
CID 55279700

Frequently Asked Questions

What is the IUPAC name of 5-ethylfuran-2-sulfonyl chloride?
The IUPAC name of 5-ethylfuran-2-sulfonyl chloride (CID 119084512) is 5-ethylfuran-2-sulfonyl chloride.
What is the SMILES notation for 5-ethylfuran-2-sulfonyl chloride?
The canonical SMILES for 5-ethylfuran-2-sulfonyl chloride is CCc1ccc(S(=O)(=O)Cl)o1.
What is the InChIKey of 5-ethylfuran-2-sulfonyl chloride?
The InChIKey is IKKZOQBZEXWPLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7ClO3S/c1-2-5-3-4-6(10-5)11(7,8)9/h3-4H,2H2,1H3.
What are the key properties of 5-ethylfuran-2-sulfonyl chloride?
5-ethylfuran-2-sulfonyl chloride has a molecular weight of 194.64 g/mol, XLogP of 1.77, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethylfuran-2-sulfonyl chloride is sourced from PubChem (CID 119084512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).