2-[2-(2-propan-2-yloxyethylsulfonyl)ethoxy]propane

C10H22O4S — CID 15864750

IUPAC2-[2-(2-propan-2-yloxyethylsulfonyl)ethoxy]propane
SMILESCC(C)OCCS(=O)(=O)CCOC(C)C
InChIInChI=1S/C10H22O4S/c1-9(2)13-5-7-15(11,12)8-6-14-10(3)4/h9-10H,5-8H2,1-4H3
InChIKeyVADXHUGRSDSGJX-UHFFFAOYSA-N
MW238.35 g/mol
LogP1.25
Rot. Bonds8

About 2-[2-(2-propan-2-yloxyethylsulfonyl)ethoxy]propane

2-[2-(2-propan-2-yloxyethylsulfonyl)ethoxy]propane (PubChem CID 15864750) has the molecular formula C10H22O4S and a molecular weight of 238.35 g/mol. Its IUPAC name is 2-[2-(2-propan-2-yloxyethylsulfonyl)ethoxy]propane.

Molecular Properties

Compound Name2-[2-(2-propan-2-yloxyethylsulfonyl)ethoxy]propane
PubChem CID15864750
Molecular FormulaC10H22O4S
Molecular Weight238.35 g/mol
Exact Mass238.12
IUPAC Name2-[2-(2-propan-2-yloxyethylsulfonyl)ethoxy]propane
SMILESCC(C)OCCS(=O)(=O)CCOC(C)C
InChIInChI=1S/C10H22O4S/c1-9(2)13-5-7-15(11,12)8-6-14-10(3)4/h9-10H,5-8H2,1-4H3
InChIKeyVADXHUGRSDSGJX-UHFFFAOYSA-N
XLogP1.25
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.35
LogP ≤ 51.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-propan-2-yloxyethylsulfonyl)ethoxy]propane?
The IUPAC name of 2-[2-(2-propan-2-yloxyethylsulfonyl)ethoxy]propane (CID 15864750) is 2-[2-(2-propan-2-yloxyethylsulfonyl)ethoxy]propane.
What is the SMILES notation for 2-[2-(2-propan-2-yloxyethylsulfonyl)ethoxy]propane?
The canonical SMILES for 2-[2-(2-propan-2-yloxyethylsulfonyl)ethoxy]propane is CC(C)OCCS(=O)(=O)CCOC(C)C.
What is the InChIKey of 2-[2-(2-propan-2-yloxyethylsulfonyl)ethoxy]propane?
The InChIKey is VADXHUGRSDSGJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O4S/c1-9(2)13-5-7-15(11,12)8-6-14-10(3)4/h9-10H,5-8H2,1-4H3.
What are the key properties of 2-[2-(2-propan-2-yloxyethylsulfonyl)ethoxy]propane?
2-[2-(2-propan-2-yloxyethylsulfonyl)ethoxy]propane has a molecular weight of 238.35 g/mol, XLogP of 1.25, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-propan-2-yloxyethylsulfonyl)ethoxy]propane is sourced from PubChem (CID 15864750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).