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Name |
2-(Ethylamino)propiophenone hydrochloride |
EINECS | 200-659-6 |
CAS No. | 51553-17-4 | Density | N/A |
PSA | 29.10000 | LogP | 3.06020 |
Solubility | N/A | Melting Point |
195-198 °C |
Formula | C11H15NO.HCl | Boiling Point | 272.3 °C at 760 mmHg |
Molecular Weight | 213.707 | Flash Point | 105 °C |
Transport Information | N/A | Appearance | white solid |
Safety | 26-36 | Risk Codes | 36/37/38 |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
1-Propanone, 2-(ethylamino)-1-phenyl-, hydrochloride (9CI);RMI 8201A;2-(Ethylamino)-1-phenyl-1-propanone hydrochloride;2-(Ethylamino)-1-phenyl-1-propanone hydrochloride (1:1); |
Article Data | 1 |
The 2-(Ethylamino)propiophenone hydrochloride, with the CAS registry number 51553-17-4, is also known as 1-Propanone, 2-(ethylamino)-1-phenyl-, hydrochloride (9CI). It belongs to the product categories of Various Metabolites and Impurities; Intermediates & Fine Chemicals; Metabolites & Impurities; Pharmaceuticals; C11 to C12; Carbonyl Compounds; Ketones. This chemical's molecular formula is C11H15NO·HCl and molecular weight is 213.70. What's more, its systematic name is 2-(Ethylamino)-1-phenyl-1-propanone hydrochloride (1:1). This chemical should be sealed and stored in a cool and dry place. It is used as a metabolite of Diethylpropion.
Physical properties of 2-(Ethylamino)propiophenone hydrochloride are: (1)ACD/LogP: 1.926; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.29; (4)ACD/LogD (pH 7.4): 1.74; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 11.07; (7)ACD/KOC (pH 5.5): 6.17; (8)ACD/KOC (pH 7.4): 171.81; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 20.31 Å2.
When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c1ccccc1)C(NCC)C.Cl
(2)Std. InChI: InChI=1S/C11H15NO.ClH/c1-3-12-9(2)11(13)10-7-5-4-6-8-10;/h4-9,12H,3H2,1-2H3;1H
(3)Std. InChIKey: XCVDYVFUJZVVKL-UHFFFAOYSA-N