The N-Boc-trans-4-hydroxy-d-proline methyl ester, with CAS registry number 135042-17-0, has the systematic name of 1-tert-butyl 2-methyl (2R,4S)-4-hydroxypyrrolidine-1,2-dicarboxylate. Besides this, it is also called (2R,4S)-1-tert-butyl 2-methyl 4-hydroxypyrrolidine-1,2-dicarboxylate. And the chemical formula of this chemical is C11H19NO5.
Physical properties of N-Boc-trans-4-hydroxy-d-proline methyl ester: (1)ACD/LogP: -0.25; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 6; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 5; (6)Polar Surface Area: 65.07 Å2; (7)Index of Refraction: 1.5; (8)Molar Refractivity: 59.36 cm3; (9)Molar Volume: 201.5 cm3; (10)Polarizability: 23.53×10-24cm3; (11)Surface Tension: 46.9 dyne/cm; (12)Density: 1.216 g/cm3; (13)Flash Point: 156.6 °C; (14)Enthalpy of Vaporization: 67 kJ/mol; (15)Boiling Point: 335.2 °C at 760 mmHg; (16)Vapour Pressure: 8.47E-06 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC(C)(C)C)N1[C@@H](C(=O)OC)C[C@H](O)C1
(2)InChI: InChI=1/C11H19NO5/c1-11(2,3)17-10(15)12-6-7(13)5-8(12)9(14)16-4/h7-8,13H,5-6H2,1-4H3/t7-,8+/m0/s1
(3)InChIKey: MZMNEDXVUJLQAF-JGVFFNPUBA
(4)Std. InChI: InChI=1S/C11H19NO5/c1-11(2,3)17-10(15)12-6-7(13)5-8(12)9(14)16-4/h7-8,13H,5-6H2,1-4H3/t7-,8+/m0/s1
(5)Std. InChIKey: MZMNEDXVUJLQAF-JGVFFNPUSA-N
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