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Basic Information
CAS No.: 1459-22-9
Name: 1-(2-Bromobenzyl)piperidine
Article Data: 1
Molecular Structure:
Molecular Structure of 1459-22-9 (1-(2-Bromobenzyl)piperidine)
Formula: C12H16BrN
Molecular Weight: 254.17
Synonyms: Piperidine,1-(o-bromobenzyl)- (7CI,8CI);
Density: 1.323 g/cm3
Boiling Point: 299.076 °C at 760 mmHg
Flash Point: 134.677 °C
Hazard Symbols: IrritantXi
Risk Codes:  Xi:Irritant;
">  Xi:Irritant;
PSA: 3.24000
LogP: 3.37290
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Specification

The Piperidine,1-[(2-bromophenyl)methyl]-, with the CAS registry number 1459-22-9, belongs to the product categories of Aryl; Organohalides. This chemical's molecular formula is C12H16BrN and molecular weight is 254.1661. Its systematic name is called 1-(2-bromobenzyl)piperidine. When you are using this chemical, please be cautious about it. This chemical may cause inflammation to the skin or other mucous membranes.

Physical properties of Piperidine,1-[(2-bromophenyl)methyl]-: (1)ACD/LogP: 3.78; (2)ACD/LogD (pH 5.5): 1; (3)ACD/LogD (pH 7.4): 2; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 22; (6)ACD/KOC (pH 5.5): 4; (7)ACD/KOC (pH 7.4): 155; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 2; (10)Index of Refraction: 1.575; (11)Molar Refractivity: 63.482 cm3; (12)Molar Volume: 192.003 cm3; (13)Surface Tension: 43.089 dyne/cm; (14)Density: 1.324 g/cm3; (15)Flash Point: 134.677 °C; (16)Enthalpy of Vaporization: 53.904 kJ/mol; (17)Boiling Point: 299.076 °C at 760 mmHg; (18)Vapour Pressure: 0.001 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Brc2ccccc2CN1CCCCC1
(2)InChI: InChI=1/C12H16BrN/c13-12-7-3-2-6-11(12)10-14-8-4-1-5-9-14/h2-3,6-7H,1,4-5,8-10H2
(3)InChIKey: YHPWAILJEPQMRO-UHFFFAOYAT