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CAS No.: | 1225622-14-9 |
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Name: | 4-Ethylmethcathinone |
Molecular Structure: | |
Formula: | C12H17NO |
Molecular Weight: | 191.27 |
Synonyms: | ipo-33;4-ethylmethcathinone 4emc;4-cdc 4CDC crystals China supplier;best prices crystal 4emc 4-emc 4EMC;high quality 4cec low price hot sale;1-(4-Ethylphenyl)-2-(methylamino)-1-propanone;1-Propanone, 1-(4-ethylphenyl)-2-(MethylaMino)-;4-EMC 99% 4 Emc Research Chemicals Crystal Recreational Designer Drug |
Density: | 0.976 g/cm3 |
Boiling Point: | 305.117 °C at 760 mmHg |
Flash Point: | 116.199 °C |
PSA: | 29.10000 |
LogP: | 2.43050 |
The 1-(4-Ethylphenyl)-2-(methylamino)propan-1-one, with the CAS registry number 1225622-14-9, is also known as 1-Propanone, 1-(4-ethylphenyl)-2-(methylamino)-. This chemical's molecular formula is C12H17NO and molecular weight is 191.27. What's more, its systematic name is 1-(4-Ethylphenyl)-2-(methylamino)propan-1-one.
Physical properties of 1-(4-Ethylphenyl)-2-(methylamino)propan-1-one are: (1)ACD/LogP: 1.186; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 7.4): 0.90; (4)ACD/BCF (pH 5.5): 1.00; (5)ACD/BCF (pH 7.4): 2.41; (6)ACD/KOC (pH 5.5): 1.47; (7)ACD/KOC (pH 7.4): 54.15; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 4; (11)Polar Surface Area: 29.1 Å2; (12)Index of Refraction: 1.51; (13)Molar Refractivity: 58.649 cm3; (14)Molar Volume: 195.987 cm3; (15)Polarizability: 23.25×10-24cm3; (16)Surface Tension: 34.203 dyne/cm; (17)Density: 0.976 g/cm3; (18)Flash Point: 116.199 °C; (19)Enthalpy of Vaporization: 54.553 kJ/mol; (20)Boiling Point: 305.117 °C at 760 mmHg; (21)Vapour Pressure: 0.001 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: CCc1ccc(cc1)C(=O)C(C)NC
(2)Std. InChI: InChI=1S/C12H17NO/c1-4-10-5-7-11(8-6-10)12(14)9(2)13-3/h5-9,13H,4H2,1-3H3
(3)Std. InChIKey: FUYPDKFWOHBUFT-UHFFFAOYSA-N