Acetamidine, 2,2'-dithiobis(N-cyclopentylmethyl-, dihydrochloride
Basic information
- CAS
40284-17-1- Standard SMILES
NC(CSSCC(N)=[NH+]CC1CCCC1)=[NH+]CC1CCCC1.[Cl-].[Cl-]- InChIKey
KFRSAMMHRXBCJH-UHFFFAOYSA-N- Molecular formula
- C16H32Cl2N4S2
- Average molar mass
- 415.5 g/mol
- Monoisotopic mass
- 414.1445448
Names & identifiers
- Preferred name
- Acetamidine, 2,2'-dithiobis(N-cyclopentylmethyl-, dihydrochloride
- IUPAC
- [1-amino-2-[[2-amino-2-(cyclopentylmethylazaniumylidene)ethyl]disulfanyl]ethylidene]-(cyclopentylmethyl)azanium dichloride
Names & synonyms
2,2'-Dithiobis(N-cyclopentylmethylacetamidine) dihydrochloride40284-17-1ACETAMIDINE, 2,2'-DITHIOBIS(N-CYCLOPENTYLMETHYL-, DIHYDROCHLORIDERefChem:315635
Database identifiers
- CAS
40284-17-1- PubChem CID
- 38427
Properties
Computed structural properties
- Topological polar surface area
- 131 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 336
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Compound notes
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