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Pyrrolidine,2-(4-fluorophenyl)-, (2S)- (298690-90-1)

Identification
Name:Pyrrolidine,2-(4-fluorophenyl)-, (2S)-
Synonyms:(S)-2-(4-Fluorophenyl)pyrrolidine;
CAS:298690-90-1
Molecular Formula: C10H12FN
Molecular Weight: 165.21
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-/m0/s1
Molecular Structure: (C10H12FN) (S)-2-(4-Fluorophenyl)pyrrolidine;
Properties
Density:1.078 g/cm3
Refractive index:1.515
Specification:

The (S)-2-(4-Fluorophenyl)pyrrolidine, with cas registry number 298690-90-1, has the systematic name of (2S)-2-(4-fluorophenyl)pyrrolidine. And it is also called pyrrolidine, 2-(4-fluorophenyl)-, (2S)-. The chemical formula of this chemical is C10H12FN.

Physical properties about this chemical are: (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)Enthalpy of Vaporization: 47.23 kJ/mol; (19)Vapour Pressure: 0.0497 mmHg at 25°C.

You can still convert the following datas into 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-/m0/s1
(3)InChIKey: ZDCXMSDSTZZWAX-JTQLQIEIBL
(4)Std. InChI: InChI=1S/C10H12FN/c11-9-5-3-8(4-6-9)10-2-1-7-12-10/h3-6,10,12H,1-2,7H2/t10-/m0/s1
(5)Std. InChIKey: ZDCXMSDSTZZWAX-JTQLQIEISA-N

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