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Ethyl tert-butyl disulphide

HCID 138136
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Basic information

CAS
102107-90-4
Standard SMILES
CCSSC(C)(C)C
InChIKey
CLMXSBZIYJITQU-UHFFFAOYSA-N
Molecular formula
C6H14S2
Average molar mass
150.3 g/mol
Monoisotopic mass
150.05369279

Names & identifiers

Preferred name
Ethyl tert-butyl disulphide
IUPAC
2-(ethyldisulfanyl)-2-methylpropane

Names & synonyms

Ethyl tert-butyl disulphideDisulfide, tert-butyl ethylDisulfide, 1,1-dimethylethyl ethyl2-(Ethyldisulfanyl)-2-methylpropaneEthyl t-butyl disulfideEthyl tert-butyl disulfide102107-90-4tert-Butyl Ethyl disulfideEthyl tert butyl disulfideSCHEMBL575908SCHEMBL18263770SCHEMBL18263937
Show more names
2,2-Dimethyl-3,4-dithiahexaneDTXSID409071002-Methyl-2-propyl ethyl disulfide2-(ethyldisulfanyl)-2-methyl-propane2-(Ethyldisulfanyl)-2-methylpropane #

Database identifiers

CAS
102107-90-4、4151-69-3
PubChem CID
138136
DTXSID
DTXSID40907100
Nikkaji
J99.998I

Properties

Computed structural properties

XLogP
2.3
Topological polar surface area
50.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
8
Formal charge
0
Complexity
54

Experimental & physicochemical properties

SpringerMaterials PropertiesBoiling point

Related reactions

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Compound notes

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