(R)-2-(4-Fluorophenyl)pyrrolidine supplier

Name
(R)-2-(4-Fluorophenyl)pyrrolidine
EINECS
CAS No. 298690-89-8
Article Data5
CAS DataBase
Density 1.078 g/cm³
Solubility
Melting Point
Formula C₁₀H₁₂FN
Boiling Point 235.5 °C at 760 mmHg
Molecular Weight 165.21
Flash Point 96.3 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms (2R)-2-(4-Fluorophenyl)pyrrolidine;pyrrolidine, 2-(4-fluorophenyl)-, (2R)-;
PSA 12.03000
LogP 2.57900

(R)-2-(4-Fluorophenyl)pyrrolidine Specification

The (R)-2-(4-Fluorophenyl)pyrrolidine, with the CAS registry number 298690-89-8, has the systematic name of (2R)-2-(4-fluorophenyl)pyrrolidine. It belongs to the following product category of API intermediates. And the molecular formula of the chemical is C₁₀H₁₂FN.

The characteristics of this chemical are as followings: (1)ACD/LogP: 1.83; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.26; (4)ACD/LogD (pH 7.4): -0.92; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 3.24 Å²; (13)Index of Refraction: 1.515; (14)Molar Refractivity: 46.23 cm³; (15)Molar Volume: 153.1 cm³; (16)Polarizability: 18.32×10^-24cm³; (17)Surface Tension: 35.3 dyne/cm; (18)Density: 1.078 g/cm³; (19)Flash Point: 96.3 °C; (20)Enthalpy of Vaporization: 47.23 kJ/mol; (21)Boiling Point: 235.5 °C at 760 mmHg; (22)Vapour Pressure: 0.0497 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Fc1ccc(cc1)[C@@H]2NCCC2
(2)InChI: InChI=1/C10H12FN/c11-9-5-3-8(4-6-9)10-2-1-7-12-10/h3-6,10,12H,1-2,7H2/t10-/m1/s1
(3)InChIKey: ZDCXMSDSTZZWAX-SNVBAGLBBZ

Product Name

(R)-2-(4-Fluorophenyl)pyrrolidine

(R)-2-(4-Fluorophenyl)pyrrolidine Specification

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