Dithiobischoline
Basic information
- CAS
4468-11-5- Standard SMILES
C[N+](C)(C)CCSSCC[N+](C)(C)C- InChIKey
ZZEBJTBRKQKJBO-UHFFFAOYSA-N- Molecular formula
- C10H26N2S2+2
- Average molar mass
- 238.5 g/mol
- Monoisotopic mass
- 238.15374118
Overview
affinity oxidizing agent
Names & identifiers
- Preferred name
- Dithiobischoline
- IUPAC
- trimethyl-[2-[2-(trimethylazaniumyl)ethyldisulfanyl]ethyl]azanium
Names & synonyms
Dithiobischoline4468-11-5RefChem:135194Ethanaminium, 2,2'-dithiobis(N,N,N-trimethyl-F0861-0061trimethyl-[2-[2-(trimethylazaniumyl)ethyldisulfanyl]ethyl]azaniumSCHEMBL5694361DTXSID20963264SMSSF-0061769STL327216AKOS022121962NCGC00342308-01
Show more names
AB01333007-022,2'-disulfanediylbis(N,N,N-trimethylethanaminium)2,2'-Disulfanediylbis(N,N,N-trimethylethan-1-aminium)1-(trimethylammonio)-2-[2-(trimethylammonio)ethyldithio]ethane
Database identifiers
- CAS
4468-11-5- PubChem CID
- 82679
- DTXSID
DTXSID20963264- Nikkaji
- J1.471.302F
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 50.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 14
- Formal charge
- 2
- Complexity
- 129
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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