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CAS No.: | 14530-33-7 |
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Name: | 1-Phenyl-2-(1-pyrrolidinyl)-1-pentanone |
Molecular Structure: | |
Formula: | C15H21NO |
Molecular Weight: | 231.33 |
Synonyms: | alpha-Pyrrolidinopentiophenone;1-Phenyl-2-(pyrrolidin-1-yl)pentan-1-one;2-Pyrrolidin-1-yl-1-phenylpentan-1-one;1-Pentanone, 1-phenyl-2-(1-pyrrolidinyl)-;α-PVP; |
Density: | 1.031 g/cm3 |
Boiling Point: | 340.8 °C at 760 mmHg |
Flash Point: | 119 °C |
DesMethyl Pyrovalerone with CAS registry number of 14530-33-7 is also known as 2-Pyrrolidin-1-yl-1-phenylpentan-1-one,alpha-Pyrrolidinovalerophenone,α-PVP, O-2387,alpha-PVP. The systematic name is 1-Phenyl-2-(pyrrolidin-1-yl)pentan-1-one. In addition, the formula is C15H21NO and the molecular weight is 231.33. DesMethyl Pyrovalerone is believed to act similarly to the designer drug MDPV, which acts as a norepinephrine-dopamine reuptake inhibitor (NDRI), although no substantial research on this compound has been conducted.
Physical properties of DesMethyl Pyrovalerone: (1)ACD/LogP: 3.12±0.32; (2)# of Rule of 5 Violations:; (3)ACD/LogD (pH 5.5): 2.42; (4)ACD/LogD (pH 7.4): 3.10; (5)ACD/BCF (pH 5.5): 27.43; (6)ACD/BCF (pH 7.4): 132.23; (7)ACD/KOC (pH 5.5): 234.80; (8)ACD/KOC (pH 7.4): 1131.92; (9)#H bond acceptors: 2; (10)#H bond donors:; (11)#Freely Rotating Bonds: 6; (12)Index of Refraction: 1.539; (13)Molar Refractivity: 70.1±0.3 cm3; (14)Molar Volume: 223.6±3.0 cm3; (15)Polarizability: 27.8±0.5 10-24cm3; (16)Surface Tension: 41.7±3.0 dyne/cm; (17)Density:1.0±0.1 g/cm3; (18)Flash Point: 144.4±15.3 °C ; (19)Enthalpy of Vaporization: 63.0±3.0 kJ/mol; (20)Boiling Point: 382.0±35.0 °C at 760 mmHg (21)Vapour Pressure: 0.0±0.9 mmHg at 25°C.
Uses of DesMethyl Pyrovalerone: DesMethyl Pyrovalerone is a stimulant compound developed in the 1960s and related to Pyrovalerone (P99775), which has been reported as a novel designer drug.
You can still convert the following datas into molecular structure:
(1) SMILES: O=C(c1ccccc1)C(N2CCCC2)CCC;
(2) InChI: InChI=1/C15H21NO/c1-2-8-14(16-11-6-7-12-16)15(17)13-9-4-3-5-10-13/h3-5,9-10,14H,2,6-8,11-12H2,1H3;
(3) InChIKey: YDIIDRWHPFMLGR-UHFFFAOYAL;
(4) Std. InChI: InChI=1S/C15H21NO/c1-2-8-14(16-11-6-7-12-16)15(17)13-9-4-3-5-10-13/h3-5,9-10,14H,2,6-8,11-12H2,1H3;
(5) Std. InChIKey: YDIIDRWHPFMLGR-UHFFFAOYSA-N.