3-Thiophenemethanol, alpha-(1-(sec-butylamino)ethyl)-, hydrochloride
Basic information
- CAS
31648-07-4- Standard SMILES
CCC(C)NC(C)C(O)c1ccsc1.Cl- InChIKey
ONYQEJAHCBSLGU-UHFFFAOYSA-N- Molecular formula
- C11H20ClNOS
- Average molar mass
- 249.8 g/mol
- Monoisotopic mass
- 249.0954131
Names & identifiers
- Preferred name
- 3-Thiophenemethanol, alpha-(1-(sec-butylamino)ethyl)-, hydrochloride
- IUPAC
- 2-(butan-2-ylamino)-1-thiophen-3-ylpropan-1-ol;hydrochloride
Names & synonyms
31648-07-4alpha-(1-(sec-Butylamino)ethyl)-3-thiophenemethanol hydrochloride3-Thiophenemethanol, alpha-(1-(sec-butylamino)ethyl)-, hydrochlorideRefChem:282791DTXSID709536152-[(Butan-2-yl)amino]-1-(thiophen-3-yl)propan-1-ol--hydrogen chloride (1/1)
Database identifiers
- CAS
31648-07-4- PubChem CID
- 208103
- DTXSID
DTXSID70953615
Properties
Computed structural properties
- Topological polar surface area
- 60.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 165
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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