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Cas Database |
| Name |
Carbamic acid,N-[(3S)-tetrahydro-2,6-dioxo-2H-pyran-3-yl]-, 1,1-dimethylethyl ester |
EINECS | N/A |
| CAS No. | 2420-13-5 | Density | 1.22 g/cm3 |
| PSA | 81.70000 | LogP | 1.13420 |
| Solubility | N/A | Melting Point |
115-116 °C(Solv: acetone (67-64-1); ethyl ether (60-29-7); ligroine (8032-32-4)) |
| Formula | C10H15NO5 | Boiling Point | 399 °C at 760 mmHg |
| Molecular Weight | 229.23 | Flash Point | 195.1 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
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Hazard Symbols | N/A |
| Synonyms |
Carbamicacid, (tetrahydro-2,6-dioxo-2H-pyran-3-yl)-, 1,1-dimethylethyl ester, (S)-(9CI);Glutamic anhydride, N-carboxy-, tert-butyl ester, L- (8CI); |
Article Data | 3 |
Carbamic acid,N-[(3S)-tetrahydro-2,6-dioxo-2H-pyran-3-yl]-, 1,1-dimethylethyl ester Specification
The Carbamic acid,N-[(3S)-tetrahydro-2,6-dioxo-2H-pyran-3-yl]-, 1,1-dimethylethyl ester is an organic compound with the formula C10H15NO5. The IUPAC name of this chemical is tert-butyl N-[(3S)-2,6-dioxooxan-3-yl]carbamate. With the CAS registry number 2420-13-5, it is also named as (S)-(2,6-Dioxo-tetrahydro-pyran-3-yl)-carbamic acid tert-butyl ester.
Physical properties about Carbamic acid,N-[(3S)-tetrahydro-2,6-dioxo-2H-pyran-3-yl]-, 1,1-dimethylethyl ester are: (1)#H bond acceptors: 6; (2)#H bond donors: 1; (3)#Freely Rotating Bonds: 3; (4)Polar Surface Area: 81.7 Å2; (5)Index of Refraction: 1.484; (6)Molar Refractivity: 53.76 cm3; (7)Molar Volume: 187.8 cm3; (8)Polarizability: 21.31×10-24cm3; (9)Surface Tension: 42.5 dyne/cm; (10)Density: 1.22 g/cm3; (11)Flash Point: 195.1 °C; (12)Enthalpy of Vaporization: 64.97 kJ/mol; (13)Boiling Point: 399 °C at 760 mmHg; (14)Vapour Pressure: 1.41E-06 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C1OC(=O)CC[C@@H]1NC(=O)OC(C)(C)C
(2)InChI: InChI=1/C10H15NO5/c1-10(2,3)16-9(14)11-6-4-5-7(12)15-8(6)13/h6H,4-5H2,1-3H3,(H,11,14)/t6-/m0/s1
(3)InChIKey: XPWLCDJCIMBIBS-LURJTMIEBZ
(4)Std. InChI: InChI=1S/C10H15NO5/c1-10(2,3)16-9(14)11-6-4-5-7(12)15-8(6)13/h6H,4-5H2,1-3H3,(H,11,14)/t6-/m0/s1
(5)Std. InChIKey: XPWLCDJCIMBIBS-LURJTMIESA-N
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