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Cas Database |
| Name |
Carbamic acid, ethyl-4-piperidinyl-, 1,1-dimethylethylester (9CI) |
EINECS | 812-964-7 |
| CAS No. | 313977-45-6 | Density | 1 g/cm3 |
| PSA | 41.57000 | LogP | 2.32420 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C12H24N2O2 | Boiling Point | 305 °C at 760 mmHg |
| Molecular Weight | 228.335 | Flash Point | 138.2 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
4-Boc-4-Ethylaminopiperidine;Tert-butyl ethyl(piperidin-4-yl)carbamate;Tert-butyl ethyl(piperidine-4-yl)carbaMate;tert-butyl 4-(ethylaMino)piperidine-4-carboxylate;tert-Butyl N-(ethyl)-N-(piperidin-4-yl)carbamate |
Article Data | 2 |
Carbamic acid, ethyl-4-piperidinyl-, 1,1-dimethylethylester (9CI) Specification
The Carbamic acid, ethyl-4-piperidinyl-, 1,1-dimethylethylester (9CI), with the CAS registry number 313977-45-6, is also known as 1,1-Dimethylethyl N-ethyl-N-4-piperidinylcarbamate. This chemical's molecular formula is C12H24N2O2 and molecular weight is 228.33116. Its IUPAC name is called tert-butyl N-ethyl-N-piperidin-4-ylcarbamate.
Physical properties of Carbamic acid, ethyl-4-piperidinyl-, 1,1-dimethylethylester (9CI): (1)ACD/LogP: 2.34; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1.02; (6)#H bond acceptors: 4; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 4; (9)Index of Refraction: 1.484; (10)Molar Refractivity: 64.93 cm3; (11)Molar Volume: 226.7 cm3; (12)Surface Tension: 36 dyne/cm; (13)Density: 1 g/cm3; (14)Flash Point: 138.2 °C; (15)Enthalpy of Vaporization: 54.54 kJ/mol; (16)Boiling Point: 305 °C at 760 mmHg; (17)Vapour Pressure: 0.000846 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCN(C1CCNCC1)C(=O)OC(C)(C)C
(2)InChI: InChI=1S/C12H24N2O2/c1-5-14(10-6-8-13-9-7-10)11(15)16-12(2,3)4/h10,13H,5-9H2,1-4H3
(3)InChIKey: JGRCDKUNLLBMTE-UHFFFAOYSA-N
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