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2,2'-Dithiobis(4-tert-butyl-1-isopropyl-1H-imidazole)

HCID 100618
NotesReactions
Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
61747-35-1
Standard SMILES
CC(C)n1cc(C(C)(C)C)nc1SSc1nc(C(C)(C)C)cn1C(C)C
InChIKey
UACGDGTZNFKYQI-UHFFFAOYSA-N
Molecular formula
C20H34N4S2
Average molar mass
394.6 g/mol
Monoisotopic mass
394.22248945

Names & identifiers

Preferred name
2,2'-Dithiobis(4-tert-butyl-1-isopropyl-1H-imidazole)
IUPAC
4-tert-butyl-2-[(4-tert-butyl-1-propan-2-ylimidazol-2-yl)disulfanyl]-1-propan-2-ylimidazole
English name
2,2'-dithiobis(4-tert-butyl-1-isopropyl-1H-imidazole)
Molecular formula
C20H34N4S2
Molecular weight
394.64

Names & synonyms

61747-35-12,2'-Dithiobis(4-tert-butyl-1-isopropyl-1H-imidazole)M7VEM74URKEINECS 262-955-1UNII-M7VEM74URKNSC 331808NSC-331808DTXSID302107512,2'-Dithiobis(4-tert-butyl-1-isopropylimidazole)1H-Imidazole, 2,2'-dithiobis[4-(1,1-dimethylethyl)-1-(1-methylethyl)-1H-IMIDAZOLE, 2,2'-DITHIOBIS(4-(1,1-DIMETHYLETHYL)-1-(1-METHYLETHYL)-2,2'-DITHIOBIS(4-(1,1-DIMETHYLETHYL)-1-(1-METHYLETHYL)-1H-IMIDAZOLE)
Show more names
2,2''-DITHIOBIS(4-TERT-BUTYL-1-ISOPROPYL-IMIDAZOLE)Bis(4-tert-butyl-1-isopropyl-1H-imidazol-2-yl) persulfideBis(1-isopropyl-4-tert-butyl-1H-imidazole-2-yl) persulfide
2,2'-Dithiobis[4-(1,1-dimethylethyl)-1-(1-methylethyl)-1H-imidazole]RefChem:80724DTXCID60133242262-955-1NSC3318081,2-bis(4-(tert-butyl)-1-isopropyl-1H-imidazol-2-yl)disulfanestarbld0006479SCHEMBL1760440

Database identifiers

Properties

Computed structural properties

XLogP
5.7
Topological polar surface area
86.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
7
Heavy atoms
26
Formal charge
0
Complexity
414

Experimental & physicochemical properties

LogP4.1

Physicochemical properties

FDA UNII
7 VEM74URK · M7VEM74URK

Chemistry & industry

Suppliers2 total

CHEMICAL LAND21[email protected]
SIGMAALDRICH—

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
CAS
61747-35-1
PubChem CID
100618
DTXSID
DTXSID30210751
UNII
M7VEM74URK
EC Number
262-955-1
Nikkaji
J236.502B