Ethanone, 2-(diethylamino)-1-(3,4-dihydroxyphenyl)-, hydrochloride
Basic information
- CAS
71595-23-8- Standard SMILES
CCN(CC)CC(=O)c1ccc(O)c(O)c1.Cl- InChIKey
UGWLTAYGTKUEQT-UHFFFAOYSA-N- Molecular formula
- C12H18ClNO3
- Average molar mass
- 259.73 g/mol
- Monoisotopic mass
- 259.0975211
Names & identifiers
- Preferred name
- Ethanone, 2-(diethylamino)-1-(3,4-dihydroxyphenyl)-, hydrochloride
- IUPAC
- 2-(diethylamino)-1-(3,4-dihydroxyphenyl)ethanone;hydrochloride
Names & synonyms
71595-23-8Ethanone, 2-(diethylamino)-1-(3,4-dihydroxyphenyl)-, hydrochloride2-(Diethylamino)-1-(3,4-dihydroxyphenyl)ethanone hydrochlorideDTXSID70221826NSC 23630RefChem:341399DTXCID00144317NSC23630NSC-236302-(diethylamino)-1-(3,4-dihydroxyphenyl)ethanonealpha-Diethylamino-3,4-dihydroxyacetophenone, hydrochloride2-(diethylamino)-1-(3,4-dihydroxyphenyl)ethan-1-one hydrochloride
Show more names
2-(Diethylamino)-1-(3,4-dihydroxyphenyl)ethan-1-one--hydrogen chloride (1/1)
Database identifiers
- CAS
71595-23-8- PubChem CID
- 458549
- DTXSID
DTXSID70221826
Properties
Computed structural properties
- Topological polar surface area
- 60.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 228
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Compound notes
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