2-(2-tert-butylsulfonylethyl)oxolane

C10H20O3S — CID 59159510

IUPAC2-(2-tert-butylsulfonylethyl)oxolane
SMILESCC(C)(C)S(=O)(=O)CCC1CCCO1
InChIInChI=1S/C10H20O3S/c1-10(2,3)14(11,12)8-6-9-5-4-7-13-9/h9H,4-8H2,1-3H3
InChIKeyJWYZHNFUEAVBRL-UHFFFAOYSA-N
MW220.33 g/mol
LogP1.77
Rot. Bonds3

About 2-(2-tert-butylsulfonylethyl)oxolane

2-(2-tert-butylsulfonylethyl)oxolane (PubChem CID 59159510) has the molecular formula C10H20O3S and a molecular weight of 220.33 g/mol. Its IUPAC name is 2-(2-tert-butylsulfonylethyl)oxolane.

Molecular Properties

Compound Name2-(2-tert-butylsulfonylethyl)oxolane
PubChem CID59159510
Molecular FormulaC10H20O3S
Molecular Weight220.33 g/mol
Exact Mass220.11
IUPAC Name2-(2-tert-butylsulfonylethyl)oxolane
SMILESCC(C)(C)S(=O)(=O)CCC1CCCO1
InChIInChI=1S/C10H20O3S/c1-10(2,3)14(11,12)8-6-9-5-4-7-13-9/h9H,4-8H2,1-3H3
InChIKeyJWYZHNFUEAVBRL-UHFFFAOYSA-N
XLogP1.77
TPSA43.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.33
LogP ≤ 51.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-(tert-butylsulfonylmethyl)oxolane
CID 165172638
2-(oxolan-2-yl)ethanesulfonyl chloride
CID 65158435
2-[(2S)-oxolan-2-yl]ethanesulfonyl chloride
CID 98112256
1-[2-(oxolan-2-yl)ethylsulfonyl]propan-2-amine
CID 81188285
2-[2-(oxolan-2-yl)ethylsulfonyl]propanoic acid
CID 65161065
N-(2-tert-butylsulfonylethyl)-1-(oxolan-2-yl)ethanamine
CID 113423521
(2R)-2-(methylsulfonylmethyl)oxolane
CID 68993549
N,N-dimethyl-2-[1-[2-[(2R)-oxolan-2-yl]ethylsulfonyl]piperidin-4-yl]ethanamine
CID 97339756
(2S)-2-(2,2-dimethylpropyl)oxolane
CID 58780523
(2R)-2-(2,2-dimethylpropyl)oxolane
CID 58780469
1-methylsulfonyl-5-(oxolan-2-yl)pentan-3-amine
CID 115848376
2-(5-bromo-3,3-dimethylhexyl)oxolane
CID 65165426

Frequently Asked Questions

What is the IUPAC name of 2-(2-tert-butylsulfonylethyl)oxolane?
The IUPAC name of 2-(2-tert-butylsulfonylethyl)oxolane (CID 59159510) is 2-(2-tert-butylsulfonylethyl)oxolane.
What is the SMILES notation for 2-(2-tert-butylsulfonylethyl)oxolane?
The canonical SMILES for 2-(2-tert-butylsulfonylethyl)oxolane is CC(C)(C)S(=O)(=O)CCC1CCCO1.
What is the InChIKey of 2-(2-tert-butylsulfonylethyl)oxolane?
The InChIKey is JWYZHNFUEAVBRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O3S/c1-10(2,3)14(11,12)8-6-9-5-4-7-13-9/h9H,4-8H2,1-3H3.
What are the key properties of 2-(2-tert-butylsulfonylethyl)oxolane?
2-(2-tert-butylsulfonylethyl)oxolane has a molecular weight of 220.33 g/mol, XLogP of 1.77, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-tert-butylsulfonylethyl)oxolane is sourced from PubChem (CID 59159510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).