Basic information
- CAS
68535-69-3- Standard SMILES
COc1ccccc1CNCCCCCCNCCSSCCNCCCCCCNCc1ccccc1OC.Cl.Cl.Cl.Cl- InChIKey
RTQGTSLLFQQXBL-UHFFFAOYSA-N- Molecular formula
- C32H58Cl4N4O2S2
- Average molar mass
- 736.8 g/mol
- Monoisotopic mass
- 734.27553
Names & identifiers
- Preferred name
- Bis(2-methoxybenzylaminohex-6-ylaminoethyl)disulphane
- IUPAC
- N'-[(2-methoxyphenyl)methyl]-N-[2-[2-[6-[(2-methoxyphenyl)methylamino]hexylamino]ethyldisulfanyl]ethyl]hexane-1,6-diamine;tetrahydrochloride
Names & synonyms
68535-69-3EINECS 271-296-9NSC 364369Bis(2-methoxybenzylaminohex-6-ylaminoethyl)disulphane
Database identifiers
- CAS
68535-69-3- PubChem CID
- 155129
- EC Number
- 271-296-9
Properties
Computed structural properties
- Topological polar surface area
- 117 Ų
- Hydrogen bond donors
- 8
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 27
- Heavy atoms
- 44
- Formal charge
- 0
- Complexity
- 503
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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