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Carbamic acid, N-[(1R)-2-oxo-1-phenylcyclohexyl]-, 1,1-dimethylethyl ester
化学名:Carbamic acid, N-[(1R)-2-oxo-1-phenylcyclohexyl]-, 1,1-dimethylethyl ester
CAS番号.2131792-40-8
英語名:Carbamic acid, N-[(1R)-2-oxo-1-phenylcyclohexyl]-, 1,1-dimethylethyl ester
CBNumberCB18245103
MFC17H23NO3
MW289.37
MOL File2131792-40-8.mol
Carbamic acid, N-[(1R)-2-oxo-1-phenylcyclohexyl]-, 1,1-dimethylethyl ester物理性質
沸点 | 435.2±45.0 °C(Predicted) |
比重(密度) | 1.11±0.1 g/cm3(Predicted) |
酸解離定数(Pka) | 9.83±0.20(Predicted) |
InChI | InChI=1S/C17H23NO3/c1-16(2,3)21-15(20)18-17(12-8-7-11-14(17)19)13-9-5-4-6-10-13/h4-6,9-10H,7-8,11-12H2,1-3H3,(H,18,20)/t17-/m1/s1 |
InChIKey | KFMCUWRSOZRDIN-QGZVFWFLSA-N |
SMILES | C(OC(C)(C)C)(=O)N[C@@]1(C2=CC=CC=C2)CCCCC1=O |