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(R)-2-Phenylpyrrolidine

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Name

(R)-2-Phenylpyrrolidine

EINECS N/A
CAS No. 56523-47-8 Density 0.988 g/cm3
PSA 12.03000 LogP 2.43990
Solubility N/A Melting Point N/A
Formula C10H13N Boiling Point 237 °C at 760 mmHg
Molecular Weight 147.22 Flash Point 98.3 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 56523-47-8 ((R)-2-Phenylpyrrolidine) Hazard Symbols N/A
Synonyms

Pyrrolidine,2-phenyl-, (R)-;(2R)-2-Phenylpyrrolidine;(R)-(+)-2-Phenylpyrrolidine;(R)-2-Phenylpyrrolidine;

Article Data 33

(R)-2-Phenylpyrrolidine Specification

The (R)-2-Phenylpyrrolidine, with the cas registry number 56523-47-8, has the systematic name of (2R)-2-phenylpyrrolidine. It belongs to the following product categories: pharmaceutical intermediate;Chiral heterocyclic compounds. And the molecular formula of the chemical is C10H13N.

The characteristics of this chemical are as followings: (1)ACD/LogP: 1.78; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.31; (4)ACD/LogD (pH 7.4): -1.01; (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: 1.533; (14)Molar Refractivity: 46.23 cm3; (15)Molar Volume: 148.9 cm3; (16)Polarizability: 18.33×10-24cm3; (17)Surface Tension: 36.6 dyne/cm; (18)Density: 0.988 g/cm3; (19)Flash Point: 98.3 °C; (20)Enthalpy of Vaporization: 47.38 kJ/mol; (21)Boiling Point: 237 °C at 760 mmHg; (22)Vapour Pressure: 0.0459 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: c1ccc(cc1)[C@@H]2NCCC2
(2)InChI: InChI=1/C10H13N/c1-2-5-9(6-3-1)10-7-4-8-11-10/h1-3,5-6,10-11H,4,7-8H2/t10-/m1/s1
(3)InChIKey: JUTDHSGANMHVIC-SNVBAGLBBO

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