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4-Bromopiperidine, N-CBZ protected (166953-64-6)

Identification
Name:4-Bromopiperidine, N-CBZ protected
Synonyms:benzyl 4-bromopiperidine-1-carboxylate;Benzyl 4-bromotetrahydro-1(2H)-pyridinecarboxylate, 90+%;4-bromo-n-cbz piperidine;
CAS:166953-64-6
Molecular Formula: C13H16BrNO2
Molecular Weight: 298.18
InChI: InChI=1/C13H16BrNO2/c14-12-6-8-15(9-7-12)13(16)17-10-11-4-2-1-3-5-11/h1-5,12H,6-10H2
Molecular Structure: (C13H16BrNO2) benzyl 4-bromopiperidine-1-carboxylate;Benzyl 4-bromotetrahydro-1(2H)-pyridinecarboxylate, 90+%;4-br...
Properties
Density:1.374
Refractive index:1.5590
Specification:

The Benzyl 4-bromopiperidine-1-carboxylate with cas registry number of 166953-64-6, belongs to the following product categorie: API intermediates. Its systematic name and IUPAC name are the same, which is benzyl 4-bromopiperidine-1-carboxylate. And its refractive index is 1.5590.

Physical properties about this chemical are: (1)ACD/LogP: 2.91; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.91; (4)ACD/LogD (pH 7.4): 2.91; (5)ACD/BCF (pH 5.5): 95.2; (6)ACD/BCF (pH 7.4): 95.2; (7)ACD/KOC (pH 5.5): 907.67; (8)ACD/KOC (pH 7.4): 907.67; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 29.54 Å2; (13)Index of Refraction: 1.578; (14)Molar Refractivity: 69.84 cm3; (15)Molar Volume: 210.1 cm3; (16)Polarizability: 27.69×10-24cm3; (17)Surface Tension: 49.4 dyne/cm; (18)Enthalpy of Vaporization: 63.38 kJ/mol; (19)Vapour Pressure: 3.91E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
(1)SMILES: BrC2CCN(C(=O)OCc1ccccc1)CC2;
(2)InChI: InChI=1/C13H16BrNO2/c14-12-6-8-15(9-7-12)13(16)17-10-11-4-2-1-3-5-11/h1-5,12H,6-10H2;
(3)InChIKey: BFWKSPOSMPKTSV-UHFFFAOYAR;
(4)Std. InChI: InChI=1S/C13H16BrNO2/c14-12-6-8-15(9-7-12)13(16)17-10-11-4-2-1-3-5-11/h1-5,12H,6-10H2;
(5)Std. InChIKey: BFWKSPOSMPKTSV-UHFFFAOYSA-N

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