4-Piperidinol,1-methyl-4-phenyl-, 4-propanoate supplier

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Name
4-propionyloxy-4-phenyl-N-methylpiperidine
EINECS
CAS No. 13147-09-6
Density 1.07 g/cm³
Solubility
Melting Point
Formula C₁₅H₂₁NO₂
Boiling Point 328.9 °C at 760 mmHg
Molecular Weight 247.337
Flash Point 111.6 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-Piperidinol,1-methyl-4-phenyl-, propanoate (ester) (9CI);4-Piperidinol,1-methyl-4-phenyl-, propionate (7CI);Propionic acid,1-methyl-4-phenyl-4-piperidyl ester (6CI);1-Methyl-4-phenyl-4-piperidinolpropionate;1-Methyl-4-phenyl-4-propionoxypiperidine;1-Methyl-4-phenyl-4-propionyloxypiperidine;3-Demethylprodine;Desmethylprodine;IK 13;PEPAP;
PSA 29.54000
LogP 2.49860

4-Piperidinol,1-methyl-4-phenyl-, 4-propanoate Specification

The 4-Piperidinol,1-methyl-4-phenyl-, 4-propanoate, with the CAS registry number 13147-09-6, is also known as Propionic acid, 1-methyl-4-phenyl-4-piperidyl ester. Its molecular formula is C₁₅H₂₁NO₂and its molecular weight is 247.332740. However, this chemical causes parkinsonism.

Other characteristics of the 4-Piperidinol,1-methyl-4-phenyl-, 4-propanoate can be summarised as followings: (1)ACD/LogP: 2.19; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.18; (4)ACD/LogD (pH 7.4): 1.53; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 5.91; (7)ACD/KOC (pH 5.5): 1.58; (8)ACD/KOC (pH 7.4): 80.49; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 29.54 Å²; (13)Index of Refraction: 1.541; (14)Molar Refractivity: 72.12 cm³; (15)Molar Volume: 229.2 cm³; (16)Polarizability: 28.59×10^-24cm³; (17)Surface Tension: 41.7 dyne/cm; (18)Density: 1.07 g/cm³; (19)Flash Point: 111.6 °C; (20)Enthalpy of Vaporization: 57.13 kJ/mol; (21)Boiling Point: 328.9 °C at 760 mmHg; (22)Vapour Pressure: 0.000184 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: O=C(OC2(c1ccccc1)CCN(C)CC2)CC
2.InChI: InChI=1/C15H21NO2/c1-3-14(17)18-15(9-11-16(2)12-10-15)13-7-5-4-6-8-13/h4-8H,3,9-12H2,1-2H3
3.InChIKey: BCQMRZRAWHNSBF-UHFFFAOYAP

Product Name

4-propionyloxy-4-phenyl-N-methylpiperidine

4-Piperidinol,1-methyl-4-phenyl-, 4-propanoate Specification

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