Piperazine-2,6-dione supplier

Name
Piperazine-2,6-dione
EINECS
CAS No. 4774-22-5
Article Data8
CAS DataBase
Density 1.246 g/cm³
Solubility
Melting Point >150 °C (decomp)
Formula C₄H₆N₂O₂
Boiling Point 338.6 °C at 760 mmHg
Molecular Weight 114.104
Flash Point 183 °C
Transport Information
Appearance
Safety 36/37
Risk Codes 43
Molecular Structure
Hazard Symbols
Synonyms 2,6-Dioxopiperazine;3,5-Dioxopiperazine;NSC 362116;
PSA 58.20000
LogP -1.11000

Piperazine-2,6-dione Specification

The IUPAC name of this chemical is Piperazine-2,6-dione. With the CAS registry number 4774-22-5, it is also named as 2,6-Dioxopiperazine. In addition, the formula is is C₄H₆N₂O₂ and the molecular weight is 114.1. It should be stored in a cool and dry environment.

Physical properties about Piperazine-2,6-dione are: (1)ACD/LogP: -1.14; (2)# of Rule of 5 Violations: 0 ; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 5.51; (6)ACD/KOC (pH 7.4): 5.73; (7)#H bond acceptors: 4; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 0; (10)Polar Surface Area: 40.62 Å²; (11)Index of Refraction: 1.467; (12)Molar Refractivity: 25.4 cm³; (13)Molar Volume: 91.5 cm³; (14)Polarizability: 10.07 ×10^-24cm³; (15)Surface Tension: 38.1 dyne/cm; (16)Density: 1.246 g/cm³; (17)Flash Point: 183 °C; (18)Enthalpy of Vaporization: 58.2 kJ/mol; (19)Boiling Point: 338.6 °C at 760 mmHg; (20)Vapour Pressure: 9.7E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C1NC(=O)CNC1
(2)InChI: InChI=1/C4H6N2O2/c7-3-1-5-2-4(8)6-3/h5H,1-2H2,(H,6,7,8)
(3)InChIKey: CYJAWBVQRMVFEO-UHFFFAOYAB

Product Name

Piperazine-2,6-dione

Piperazine-2,6-dione Specification

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