2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, 1-((2-aminoethyl)thio)-, monohydrochloride
Basic information
- CAS
124186-99-8- Standard SMILES
Cl.NCCS[Si]12OCCN(CCO1)CCO2- InChIKey
BUVOLLHUVFGDGQ-UHFFFAOYSA-N- Molecular formula
- C8H19ClN2O3SSi
- Average molar mass
- 286.85 g/mol
- Monoisotopic mass
- 286.0574179
Names & identifiers
- Preferred name
- 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, 1-((2-aminoethyl)thio)-, monohydrochloride
- IUPAC
- 2-(2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecan-1-ylsulfanyl)ethanamine;hydrochloride
Names & synonyms
2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, 1-((2-aminoethyl)thio)-, monohydrochloride1-((2-Aminoethyl)thio)-2,8,9-trioxa-5-aza-1-silabicyclo(3.3.3)undecane hydrochloride124186-99-8DTXSID60154230RefChem:248899DTXCID30767212-[(2,8,9-Trioxa-5-aza-1-silabicyclo[3.3.3]undecan-1-yl)sulfanyl]ethan-1-amine--hydrogen chloride (1/1)
Database identifiers
- CAS
124186-99-8- PubChem CID
- 3079050
- DTXSID
DTXSID60154230
Properties
Computed structural properties
- Topological polar surface area
- 82.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 184
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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