Butyrophenone, 3'-amino-2'-(2-(diisopropylamino)ethoxy)-, dihydrochloride
Basic information
- CAS
7241-37-4- Standard SMILES
CCCC(=O)c1cccc([NH3+])c1OCC[NH+](C(C)C)C(C)C.[Cl-].[Cl-]- InChIKey
LSGUIRTXDIVXFW-UHFFFAOYSA-N- Molecular formula
- C18H32Cl2N2O2
- Average molar mass
- 379.4 g/mol
- Monoisotopic mass
- 378.1840837
Names & identifiers
- Preferred name
- Butyrophenone, 3'-amino-2'-(2-(diisopropylamino)ethoxy)-, dihydrochloride
- IUPAC
- 2-(2-azaniumyl-6-butanoylphenoxy)ethyl-di(propan-2-yl)azanium dichloride
Names & synonyms
Butyrophenone, 5'-amino-6'-(2-(diisopropylamino)ethoxy)-, dihydrochloride2-Butyryl-6-amino-beta-(N,N-diisopropyl)phenoxyethylamine, dihydrochlorideBUTYROPHENONE, 3'-AMINO-2'-(2-(DIISOPROPYLAMINO)ETHOXY)-, DIHYDROCHLORIDE7241-37-4RefChem:331379
Database identifiers
- CAS
7241-37-4- PubChem CID
- 23665
Properties
Computed structural properties
- Topological polar surface area
- 58.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 323
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Compound notes
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