Piperidine, 1-acetyl-4-[3-(trifluoromethyl)benzoyl]- supplier

Name
1-ACETYL-4-(3-TRIFLUOROMETHYLBENZOYL)-PIPERIDINE
EINECS
CAS No. 61714-98-5
Density 1.25 g/cm³
Solubility
Melting Point
Formula C₁₅H₁₆F₃NO₂
Boiling Point 391.7 °C at 760 mmHg
Molecular Weight 299.29
Flash Point 190.7 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms (1-Acetylpiperidin-4-yl)[3-(trifluoromethyl)phenyl]methanone;
PSA 37.38000
LogP 3.08450

Piperidine, 1-acetyl-4-[3-(trifluoromethyl)benzoyl]- Specification

The Piperidine, 1-acetyl-4-[3-(trifluoromethyl)benzoyl]-, with its CAS registry number 61714-98-5, has its systematic name of (1-acetylpiperidin-4-yl)[3-(trifluoromethyl)phenyl]methanone. With its molecular formula of C₁₅H₁₆F₃NO₂ and molecular weight of 299.29, it is a kind of light yellow oil and it belongs to the product category of Aromatics.

Physical properties of Piperidine, 1-acetyl-4-[3-(trifluoromethyl)benzoyl]-: (1)ACD/LogP: 2.67; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.67; (4)ACD/LogD (pH 7.4): 2.67; (5)ACD/BCF (pH 5.5): 62.66; (6)ACD/BCF (pH 7.4): 62.66; (7)ACD/KOC (pH 5.5): 672.85; (8)ACD/KOC (pH 7.4): 672.85; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 37.38 Å²; (13)Index of Refraction: 1.5; (14)Molar Refractivity: 70.45 cm³; (15)Molar Volume: 239.2 cm³; (16)Polarizability: 27.93×10^-24cm³; (17)Surface Tension: 37.2 dyne/cm; (18)Density: 1.25 g/cm³; (19)Flash Point: 190.7 °C; (20)Enthalpy of Vaporization: 64.13 kJ/mol; (21)Boiling Point: 391.7 °C at 760 mmHg; (22)Vapour Pressure: 2.42E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES:O=C(C)N1CCC(CC1)C(=O)c2cccc(c2)C(F)(F)F
(1)InChI:InChI=1/C15H16F3NO2/c1-10(20)19-7-5-11(6-8-19)14(21)12-3-2-4-13(9-12)15(16,17)18/h2-4,9,11H,5-8H2,1H3
(1)InChIKey:BXWQFGCBTLRGQL-UHFFFAOYAJ

Product Name

1-ACETYL-4-(3-TRIFLUOROMETHYLBENZOYL)-PIPERIDINE

Piperidine, 1-acetyl-4-[3-(trifluoromethyl)benzoyl]- Specification

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