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| Name |
1-Piperazinecarboxylicacid, 4-[4-(aminomethyl)-2-pyridinyl]-, 1,1-dimethylethyl ester |
EINECS | N/A |
| CAS No. | 910036-87-2 | Density | 1.154g/cm3 |
| PSA | 71.69000 | LogP | 2.30060 |
| Solubility | N/A | Melting Point |
81.5-83 |
| Formula | C15H24N4O2 | Boiling Point | 464.8 °C at 760 mmHg |
| Molecular Weight | 292.37666 | Flash Point | 234.9 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols |
 C
|
| Synonyms |
4-[4-(Aminomethyl)pyridin-2-yl]piperazine, N1-BOC protected;tert-Butyl 4-[4-(aminomethyl)pyridin-2-yl]piperazine-1-carboxylate;tert-butyl 4-[4-(aminomethyl)pyrid-2-yl]piperazine-1-carboxylate;4-[4-(Aminomethyl)pyridin-2-yl]piperazine, N1-BOC protected 97% |
1-Piperazinecarboxylicacid, 4-[4-(aminomethyl)-2-pyridinyl]-, 1,1-dimethylethyl ester Specification
The 1-Piperazinecarboxylicacid, 4-[4-(aminomethyl)-2-pyridinyl]-, 1,1-dimethylethyl ester, with CAS registry number 910036-87-2, has the systematic name of tert-butyl 4-[4-(aminomethyl)-2-pyridyl]piperazine-1-carboxylate. This chemical may destroy living tissue on contact. And the chemical formula of this chemical is C15H24N4O2.
Physical properties of 1-Piperazinecarboxylicacid, 4-[4-(aminomethyl)-2-pyridinyl]-, 1,1-dimethylethyl ester: (1)ACD/LogP: 0.21; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 6; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 5; (6)Polar Surface Area: 71.69 Å2; (7)Index of Refraction: 1.556; (8)Molar Refractivity: 81.38 cm3; (9)Molar Volume: 253.1 cm3; (10)Polarizability: 32.26×10-24cm3; (11)Surface Tension: 49.8 dyne/cm; (12)Density: 1.154 g/cm3; (13)Flash Point: 234.9 °C; (14)Enthalpy of Vaporization: 72.63 kJ/mol; (15)Boiling Point: 464.8 °C at 760 mmHg; (16)Vapour Pressure: 8.12E-09 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: CC(C)(C)OC(=O)N1CCN(CC1)c2cc(ccn2)CN
(2)InChI: InChI=1/C15H24N4O2/c1-15(2,3)21-14(20)19-8-6-18(7-9-19)13-10-12(11-16)4-5-17-13/h4-5,10H,6-9,11,16H2,1-3H3
(3)InChIKey: FOCCRLWIOGAIGE-UHFFFAOYAG
(4)Std. InChI: InChI=1S/C15H24N4O2/c1-15(2,3)21-14(20)19-8-6-18(7-9-19)13-10-12(11-16)4-5-17-13/h4-5,10H,6-9,11,16H2,1-3H3
(5)Std. InChIKey: FOCCRLWIOGAIGE-UHFFFAOYSA-N
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