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524674-05-3

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Basic Information
CAS No.: 524674-05-3
Name: 2-(2,4-DIFLUORO-PHENYL)-PYRROLIDINE
Molecular Structure:
Molecular Structure of 524674-05-3 (2-(2,4-DIFLUORO-PHENYL)-PYRROLIDINE)
Formula: C10H11F2N
Molecular Weight: 183.201
Synonyms: 2-(2,4-Difluorophenyl)pyrrolidine;
Density: 1.164 g/cm3
Boiling Point: 211.5 °C at 760 mmHg
Flash Point: 81.7 °C
PSA: 12.03000
LogP: 2.71810
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Specification

The Pyrrolidine, 2-(2, 4-difluorophenyl)- has CAS registry number 524674-05-3. This chemical's molecular formula is C10H11F2N and molecular weight is 183.20. What's more, its systematic name is 2-(2, 4-Difluorophenyl)pyrrolidine.

Physical properties about Pyrrolidine, 2-(2, 4-difluorophenyl)- are: (1)ACD/LogP: 1.92; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.16; (4)ACD/LogD (pH 7.4): -0.53; (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: 1.499; (14)Molar Refractivity: 46.22 cm3; (15)Molar Volume: 157.3 cm3; (16)Polarizability: 18.32×10-24 cm3; (17)Surface Tension: 34.2 dyne/cm; (18)Density: 1.164 g/cm3; (19)Flash Point: 81.7 °C; (20)Enthalpy of Vaporization: 44.78 kJ/mol; (21)Boiling Point: 211.5 °C at 760 mmHg; (22)Vapour Pressure: 0.182 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Fc1cc(F)c(cc1)C2NCCC2
(2) InChI: InChI=1/C10H11F2N/c11-7-3-4-8(9(12)6-7)10-2-1-5-13-10/h3-4,6,10,13H,1-2,5H2
(3) InChIKey: ALDQGGCTXDBBBO-UHFFFAOYAR