CAS No.95798-22-4,1-N-CBZ-3-HYDROXY-PIPERIDINE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	95798-22-4
Name:	1-N-CBZ-3-HYDROXY-PIPERIDINE
Article Data:	14

Formula:	C₁₃H₁₇NO₃
Molecular Weight:	235.283
Synonyms:	1-Benzyloxycarbonyl-3-hydroxypiperidine;
Density:	1.22 g/cm³
Boiling Point:	384.942 °C at 760 mmHg
Flash Point:	186.606 °C
PSA:	49.77000
LogP:	1.71780

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Specification

The N-Cbz-3-hydroxypiperidine with the cas number 95798-22-4 is also called 1-Piperidinecarboxylic acid, 3-hydroxy-, phenylmethyl ester. The systematic name is benzyl 3-hydroxypiperidine-1-carboxylate. The molecular formula of this chemical is C₁₃H₁₇NO₃. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the chemical are: (1)ACD/LogP: 1.69; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.694; (4)ACD/LogD (pH 7.4): 1.694; (5)ACD/BCF (pH 5.5): 11.406; (6)ACD/BCF (pH 7.4): 11.406; (7)ACD/KOC (pH 5.5): 198.757; (8)ACD/KOC (pH 7.4): 198.757; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 49.77Å²; (13)Index of Refraction: 1.574; (14)Molar Refractivity: 63.653 cm³; (15)Molar Volume: 192.818 cm³; (16)Polarizability: 25.234×10^-24cm³; (17)Surface Tension: 53.479 dyne/cm; (18)Enthalpy of Vaporization: 66.84 kJ/mol; (19)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: c1ccc(cc1)COC(=O)N2CCCC(C2)O
(2)InChI: InChI=1/C13H17NO3/c15-12-7-4-8-14(9-12)13(16)17-10-11-5-2-1-3-6-11/h1-3,5-6,12,15H,4,7-10H2
(3)InChIKey: NDGWBAFATMSBHZ-UHFFFAOYAJ