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3-Amino-2,6-piperidinedione hydrochloride (24666-56-6)

Identification
Name:3-Amino-2,6-piperidinedione hydrochloride
Synonyms:2,6-Dioxopiperidine-3-ammonium chloride
CAS:24666-56-6
Molecular Formula: C5H9ClN2O2
Molecular Weight: 164.59
InChI: InChI=1/C5H8N2O2.ClH/c6-3-1-2-4(8)7-5(3)9;/h3H,1-2,6H2,(H,7,8,9);1H
Molecular Structure: (C5H9ClN2O2) 2,6-Dioxopiperidine-3-ammonium chloride
Properties
Specification:

The 3-Amino-2,6-piperidinedione hydrochloride with the cas number 24666-56-6 is also called 2,6-Piperidinedione,3-amino-, hydrochloride (1:1). Its molecular formula is C5H9ClN2O2. This chemical should be stored in dry and cool environment.

The properties of the chemical are: (1)ACD/LogP: -1.05; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.31; (4)ACD/LogD (pH 7.4): -1.14; (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): 5.22; (9)#H bond acceptors: 4; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 40.62 Å2; (13)Enthalpy of Vaporization: 57.74 kJ/mol; (14)Vapour Pressure: 0.000128 mmHg at 25°C.

Uses: This chemical can react with 2-bromo-benzoyl chloride to prepare 2-bromo-N-(2,6-dioxo-piperidin-3-yl)-benzamide. This reaction needs reagent aq. Na2CO3 and solvent dioxane at temperature of 0 - 20 °C. The yield is 53%.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C1NC(=O)C(N)CC1.Cl
(2)InChI: InChI=1/C5H8N2O2.ClH/c6-3-1-2-4(8)7-5(3)9;/h3H,1-2,6H2,(H,7,8,9);1H
(3)InChIKey: YCPULGHBTPQLRH-UHFFFAOYAG

Safety Data