Basic information
- CAS
19412-63-6- Standard SMILES
N=C(N)CSSCC(N)=[NH2+].O=S(=O)([O-])O- InChIKey
WBUXWJAGBBMKFF-UHFFFAOYSA-N- Molecular formula
- C4H12N4O4S3
- Average molar mass
- 276.4 g/mol
- Monoisotopic mass
- 276.0020684
Names & identifiers
- Preferred name
- Acetamidine, 2,2'-dithiodi-, hydrogen sulfate
- IUPAC
- [1-amino-2-[(2-amino-2-iminoethyl)disulfanyl]ethylidene]azanium;hydrogen sulfate
Names & synonyms
ACETAMIDINE, 2,2'-DITHIODI-, HYDROGEN SULFATE19412-63-6RefChem:10754062,2'-Dithiodiacetamidine hydrogen sulfateNSC 193456Acetamidine, 2,2'-dithiodi-, sulfate (1:1)Ethanimidamide, 2,2'-dithiobis-, sulfate (1:1)
Database identifiers
- CAS
19412-63-6- PubChem CID
- 29581
Properties
Computed structural properties
- Topological polar surface area
- 238 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 206
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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