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| CAS No.: | 674792-07-5 |
|---|---|
| Name: | 1-Boc-2,2-dimethyl-piperazine |
| Molecular Structure: | |
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| Formula: | C11H22N2O2 |
| Molecular Weight: | 214.308 |
| Synonyms: | 2,2-DIMETHYL-PIPERAZINE-1-CARBOXYLIC ACID TERT BUTYL-ESTER;1-BOC-2,2-DIMETHYL-PIPERAZINE;tert-Butyl 2,2-dimethylpiperazine-1-carboxylate;1-Piperazinecarboxylic acid, 2,2-dimethyl-, 1,1-dimethylethyl ester;4-tert-Butoxycarbonyl-3,3-dimethylpiperazine;1-boc-2,2-diMethylpiperazine hcl;1-boc-2,2-diMethylpiperazine hydrochloride |
| Density: | 0.977 g/cm3 |
| Boiling Point: | 275.1 °C at 760 mmHg |
| Flash Point: | 120.2 °C |
| PSA: | 41.57000 |
| LogP: | 1.87200 |
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Specification
The 1-Boc-2,2-dimethyl-piperazine, with the CAS registry number 674792-07-5, is also known as 1-Piperazinecarboxylic acid, 2,2-dimethyl-, 1,1-dimethylethyl ester. This chemical's molecular formula is C11H22N2O2 and molecular weight is 214.3. Its systematic name is called tert-butyl 2,2-dimethylpiperazine-1-carboxylate.
Physical properties of 1-Boc-2,2-dimethyl-piperazine: (1)ACD/LogP: 1.59; (2)ACD/LogD (pH 7.4): 1.32; (3)#H bond acceptors: 4; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 2; (6)Index of Refraction: 1.455; (7)Molar Refractivity: 59.49 cm3; (8)Molar Volume: 219.1 cm3; (9)Surface Tension: 30.1 dyne/cm; (10)Density: 0.977 g/cm3; (11)Flash Point: 120.2 °C; (12)Enthalpy of Vaporization: 51.35 kJ/mol; (13)Boiling Point: 275.1 °C at 760 mmHg; (14)Vapour Pressure: 0.00521 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: CC1(CNCCN1C(=O)OC(C)(C)C)C
(2)InChI: InChI=1/C11H22N2O2/c1-10(2,3)15-9(14)13-7-6-12-8-11(13,4)5/h12H,6-8H2,1-5H3
(3)InChIKey: DVMUNQAGXAMHOR-UHFFFAOYAR