2-(oxolan-2-yl)ethanesulfonyl chloride

C6H11ClO3S — CID 65158435

IUPAC2-(oxolan-2-yl)ethanesulfonyl chloride
SMILESO=S(=O)(Cl)CCC1CCCO1
InChIInChI=1S/C6H11ClO3S/c7-11(8,9)5-3-6-2-1-4-10-6/h6H,1-5H2
InChIKeyYEMFJZHPUGHKJO-UHFFFAOYSA-N
MW198.67 g/mol
LogP1.12
Rot. Bonds3

About 2-(oxolan-2-yl)ethanesulfonyl chloride

2-(oxolan-2-yl)ethanesulfonyl chloride (PubChem CID 65158435) has the molecular formula C6H11ClO3S and a molecular weight of 198.67 g/mol. Its IUPAC name is 2-(oxolan-2-yl)ethanesulfonyl chloride.

Molecular Properties

Compound Name2-(oxolan-2-yl)ethanesulfonyl chloride
PubChem CID65158435
Molecular FormulaC6H11ClO3S
Molecular Weight198.67 g/mol
Exact Mass198.01
IUPAC Name2-(oxolan-2-yl)ethanesulfonyl chloride
SMILESO=S(=O)(Cl)CCC1CCCO1
InChIInChI=1S/C6H11ClO3S/c7-11(8,9)5-3-6-2-1-4-10-6/h6H,1-5H2
InChIKeyYEMFJZHPUGHKJO-UHFFFAOYSA-N
XLogP1.12
TPSA43.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.67
LogP ≤ 51.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2S)-oxolan-2-yl]ethanesulfonyl chloride
CID 98112256
2-(2-tert-butylsulfonylethyl)oxolane
CID 59159510
1-[2-(oxolan-2-yl)ethylsulfonyl]propan-2-amine
CID 81188285
2-[2-(oxolan-2-yl)ethylsulfonyl]propanoic acid
CID 65161065
2,2-dimethyl-3-(oxolan-2-ylmethoxy)propane-1-sulfonyl chloride
CID 64999459
(2R)-2-(methylsulfonylmethyl)oxolane
CID 68993549
1-methylsulfonyl-5-(oxolan-2-yl)pentan-3-amine
CID 115848376
2-[3-(oxiran-2-yl)propyl]oxolane
CID 115410470
(2S)-2-(6-chlorohexyl)oxolane
CID 155932056
2-(methylamino)-N-[2-(oxan-2-yl)ethyl]ethanesulfonamide
CID 106000159
(3S)-1-[2-[(2R)-oxolan-2-yl]ethylsulfonyl]-3-piperidin-1-ylpiperidine
CID 100897842
1-chloro-N-(oxolan-2-ylmethyl)methanesulfonamide
CID 63665339

Frequently Asked Questions

What is the IUPAC name of 2-(oxolan-2-yl)ethanesulfonyl chloride?
The IUPAC name of 2-(oxolan-2-yl)ethanesulfonyl chloride (CID 65158435) is 2-(oxolan-2-yl)ethanesulfonyl chloride.
What is the SMILES notation for 2-(oxolan-2-yl)ethanesulfonyl chloride?
The canonical SMILES for 2-(oxolan-2-yl)ethanesulfonyl chloride is O=S(=O)(Cl)CCC1CCCO1.
What is the InChIKey of 2-(oxolan-2-yl)ethanesulfonyl chloride?
The InChIKey is YEMFJZHPUGHKJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11ClO3S/c7-11(8,9)5-3-6-2-1-4-10-6/h6H,1-5H2.
What are the key properties of 2-(oxolan-2-yl)ethanesulfonyl chloride?
2-(oxolan-2-yl)ethanesulfonyl chloride has a molecular weight of 198.67 g/mol, XLogP of 1.12, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxolan-2-yl)ethanesulfonyl chloride is sourced from PubChem (CID 65158435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).