Basic information
- CAS
3907-60-6- Standard SMILES
Cl.Cl.NCC(SSC(CN)c1ccccc1)c1ccccc1- InChIKey
JWHFJBVRIHOPBX-UHFFFAOYSA-N- Molecular formula
- C16H22Cl2N2S2
- Average molar mass
- 377.4 g/mol
- Monoisotopic mass
- 376.0601464
Names & identifiers
- Preferred name
- Benzeneethanamine, beta,beta'-dithiobis-, dihydrochloride
- IUPAC
- 2-[(2-amino-1-phenylethyl)disulfanyl]-2-phenylethanamine;dihydrochloride
Names & synonyms
Benzeneethanamine, beta,beta'-dithiobis-, dihydrochloride3907-60-6RefChem:1078449beta,beta'-Dithiobisbenzeneethanamine dihydrochlorideDTXSID509598922,2'-Disulfanediylbis(2-phenylethan-1-amine)--hydrogen chloride (1/2)
Database identifiers
- CAS
3907-60-6- PubChem CID
- 199259
- DTXSID
DTXSID50959892
Properties
Computed structural properties
- Topological polar surface area
- 103 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 225
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…