1,3-Propanediamine, N-(2-(2,8,9-trithia-5-aza-1-silabicyclo(3.3.3)undec-1-ylthio)ethyl)-, trihydrochloride
Basic information
- CAS
136884-66-7- Standard SMILES
Cl.Cl.Cl.NCCCNCCS[Si]12SCCN(CCS1)CCS2- InChIKey
CUZITUIBCUJZCQ-UHFFFAOYSA-N- Molecular formula
- C11H28Cl3N3S4Si
- Average molar mass
- 465.1 g/mol
- Monoisotopic mass
- 463.000092
Names & identifiers
- Preferred name
- 1,3-Propanediamine, N-(2-(2,8,9-trithia-5-aza-1-silabicyclo(3.3.3)undec-1-ylthio)ethyl)-, trihydrochloride
- IUPAC
- N'-[2-(2,8,9-trithia-5-aza-1-silabicyclo[3.3.3]undecan-1-ylsulfanyl)ethyl]propane-1,3-diamine;trihydrochloride
Names & synonyms
1,3-Propanediamine, N-(2-(2,8,9-trithia-5-aza-1-silabicyclo(3.3.3)undec-1-ylthio)ethyl)-, trihydrochlorideN-(2-(2,8,9-Trithia-5-aza-1-silabicyclo(3.3.3)undec-1-ylthio)ethyl)-1,3-propanediamine136884-66-7DTXSID90159995RefChem:219503DTXCID6082486N~1~-{2-[(2,8,9-Trithia-5-aza-1-silabicyclo[3.3.3]undecan-1-yl)sulfanyl]ethyl}propane-1,3-diamine--hydrogen chloride (1/3)
Database identifiers
- CAS
136884-66-7- PubChem CID
- 3078044
- DTXSID
DTXSID90159995
Properties
Computed structural properties
- Topological polar surface area
- 142 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 234
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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