Basic information
- CAS
17532-08-0- Standard SMILES
CCC[N+](C)(CCC)C(C)CC(O)(c1ccsc1)c1ccsc1.[I-]- InChIKey
QNUQIKHTSAOGFQ-UHFFFAOYSA-M- Molecular formula
- C19H30INOS2
- Average molar mass
- 479.5 g/mol
- Monoisotopic mass
- 479.08135
Names & identifiers
- Preferred name
- 4-Hydroxy-N-methyl-N,N-dipropyl-4,4-di(thiophen-3-yl)butan-2-aminium iodide
- IUPAC
- [4-hydroxy-4,4-di(thiophen-3-yl)butan-2-yl]-methyl-dipropylazanium iodide
Names & synonyms
17532-08-0DTXSID009386524-Hydroxy-N-methyl-N,N-dipropyl-4,4-di(thiophen-3-yl)butan-2-aminium iodideRefChem:1070812DTXCID5013671753-(Dipropylamino)-1,1-di(thien-3-yl)-1-butanol methiodide1-BUTANOL, 3-(DIPROPYLAMINO)-1,1-DI(THIEN-3-YL)-, METHIODIDE
Database identifiers
- CAS
17532-08-0- PubChem CID
- 28583
- DTXSID
DTXSID00938652
Properties
Computed structural properties
- Topological polar surface area
- 76.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 341
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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