CAS No.2758-98-7,2-Piperazinecarboxylic acid methyl ester Suppliers

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Basic Information

Molecular Structure:
CAS No.:	2758-98-7
Name:	2-Piperazinecarboxylic acid methyl ester
Article Data:	6

Formula:	C₆H₁₂N₂O₂
Molecular Weight:	144.173
Synonyms:	2-methoxycarbonyltetrahydropyrazine;2-Piperazinecarboxylic acid methyl ester;methyl 2-piperazinecarboxylate;PIPERAZINE-2-CARBOXYLIC ACID METHYL ESTER;2-carbomethoxypiperazine;PIP015;
Density:	1.059 g/cm³
Boiling Point:	223.6 °C at 760 mmHg
Flash Point:	89 °C
PSA:	50.36000
LogP:	-0.62160

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Specification

The 2-Piperazinecarboxylic acid methyl ester is an organic compound with the molecular formula C₆H₁₂N₂O₂. The IUPAC name of this chemical is methyl piperazine-2-carboxylate. The CAS registry number is 2758-98-7 and the poduct's categories is pharmacetical. In addition, the price of this product changes with the market.

The other characteristics of this product can be summarized as: (1)ACD/LogP: -1.00; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -3.72; (4)ACD/LogD (pH 7.4): -2.09; (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): 1; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Index of Refraction: 1.443; (13)Molar Refractivity: 36.09 cm³; (14)Molar Volume: 136.1 cm³; (15)Polarizability: 14.3×10^-24 cm³; (16)Surface Tension: 30.7 dyne/cm; (17)Enthalpy of Vaporization: 46.01 kJ/mol; (18)Vapour Pressure: 0.0953 mmHg at 25°C; (19)Rotatable Bond Count: 2; (20)Exact Mass: 144.089878; (21)MonoIsotopic Mass: 144.089878; (22)Topological Polar Surface Area: 50.4; (23)Heavy Atom Count: 10.

People can use the following data to convert to the molecule structure.
1. SMILES: O=C(OC)C1NCCNC1;
2. InChI: InChI=1/C6H12N2O2/c1-10-6(9)5-4-7-2-3-8-5/h5,7-8H,2-4H2,1H3;
3. InChIKey: ODQZNBWVRPKMKN-UHFFFAOYAL.