Basic information
- CAS
1072-22-6- Standard SMILES
Cl.NCCSSCCN- InChIKey
NULDEVQACXJZLL-UHFFFAOYSA-N- Molecular formula
- C4H13ClN2S2
- Average molar mass
- 188.7 g/mol
- Monoisotopic mass
- 188.0208681
Overview
See also: Cystamine Dihydrochloride (annotation moved to).
Names & identifiers
- Preferred name
- 2-[(2-Aminoethyl)disulfanyl]ethan-1-amine hydrochloride
- IUPAC
- 2-(2-aminoethyldisulfanyl)ethanamine;hydrochloride
Names & synonyms
1072-22-62-[(2-aminoethyl)disulfanyl]ethan-1-amine hydrochloride17173-68-1Ethanamine, 2,2'-dithiobis-, hydrochloride2-(2-aminoethyldisulfanyl)ethanamine;hydrochloride2,2'-Disulfanediyldiethanamine hydrochlorideNSC6138022,2'-Dithiodiethanamine hydrochlorideCystamine (hydrochloride)WLN: Z2SS2ZMLS001056759SCHEMBL196510
Show more names
CHEMBL1256388DTXSID10169152NULDEVQACXJZLL-UHFFFAOYSA-Ndi2-aminoethyl disulfide, chlorideNSC169239AKOS009157276EBC-246069NSC-169239
Database identifiers
- CAS
1072-22-6、17173-68-1、56-17-7- PubChem CID
- 167628
- DTXSID
DTXSID10169152- UNII
- C2U867X2F7
Properties
Computed structural properties
- Topological polar surface area
- 103 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 37
Experimental & physicochemical properties
Solubility31.6 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
9 records
Compound notes
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