Sulfone, bis(2-(ethylthio)ethyl)

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Basic information

CAS: 17700-30-0
Standard SMILES: CCSCCS(=O)(=O)CCSCC
InChIKey: XWIYVUKLHFASRH-UHFFFAOYSA-N
Molecular formula: C8H18O2S3
Average molar mass: 242.4 g/mol
Monoisotopic mass: 242.04689333

Names & identifiers

Preferred name: Sulfone, bis(2-(ethylthio)ethyl)
IUPAC: 1-ethylsulfanyl-2-(2-ethylsulfanylethylsulfonyl)ethane

Names & synonyms

Sulfone, bis(2-(ethylthio)ethyl)Bis(2-(ethylthio)ethyl)sulfoneBRN 1707523Bis(beta-ethylmercaptoethyl)sulfone17700-30-0DTXSID601702383-01-00-02137 (Beilstein Handbook Reference)RefChem:382583DTXCID70927291,1'-sulfonylbis[2-(ethylthio)ethane]SR-01000517713SR-01000517713-1

Show more names

1-(Ethylsulfanyl)-2-[2-(ethylsulfanyl)ethanesulfonyl]ethane

Database identifiers

CAS: 17700-30-0
PubChem CID: 205254
DTXSID: DTXSID60170238

Properties

Computed structural properties

XLogP: 1.6
Topological polar surface area: 93.1 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 4
Rotatable bonds: 8
Heavy atoms: 13
Formal charge: 0
Complexity: 178

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Compound notes

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