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Name |
2-(3-Chlorophenyl)piperazine |
EINECS | 604-604-1 |
CAS No. | 52385-79-2 | Density | 1.126 g/cm3 |
PSA | 24.06000 | LogP | 2.23150 |
Solubility | N/A | Melting Point |
N/A |
Formula | C10H13ClN2 | Boiling Point | 318.7 °C at 760 mmHg |
Molecular Weight | 196.68 | Flash Point | 146.5 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
2-(3-CHLOROPHENYL)PIPERAZINE;2-(3-Chlorophenyl)piperazine95%;2-(3-Chlorophenyl)piperazine 2HCl |
The 2-(3-Chlorophenyl)piperazine is an organic compound with the formula C10H13ClN2. The IUPAC name of this chemical is 2-(3-chlorophenyl)piperazine. With the CAS registry number 52385-79-2, it is also named as Piperazine, 2-(3-chlorophenyl)-. The product's category is Pharmacetical; API Intermediates.
Physical properties about 2-(3-Chlorophenyl)piperazine are: (1)ACD/LogP: 1.10; (2)ACD/LogD (pH 5.5): -1.92; (3)ACD/LogD (pH 7.4): -0.63; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1.77; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 6.48 Å2; (12)Index of Refraction: 1.536; (13)Molar Refractivity: 54.48 cm3; (14)Molar Volume: 174.6 cm3; (15)Polarizability: 21.59×10-24cm3; (16)Surface Tension: 38.4 dyne/cm; (17)Density: 1.126 g/cm3; (18)Flash Point: 146.5 °C; (19)Enthalpy of Vaporization: 56.02 kJ/mol; (20)Boiling Point: 318.7 °C at 760 mmHg; (21)Vapour Pressure: 0.000356 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc1cc(ccc1)C2NCCNC2
(2)InChI: InChI=1/C10H13ClN2/c11-9-3-1-2-8(6-9)10-7-12-4-5-13-10/h1-3,6,10,12-13H,4-5,7H2
(3)InChIKey: XRVXSYWJPAAOBC-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C10H13ClN2/c11-9-3-1-2-8(6-9)10-7-12-4-5-13-10/h1-3,6,10,12-13H,4-5,7H2
(5)Std. InChIKey: XRVXSYWJPAAOBC-UHFFFAOYSA-N