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CAS No.: | 52060-75-0 |
---|---|
Name: | 1-(1,2-DIOXOPROPYL)-L-PROLINE, METHYL ESTER |
Article Data: | 6 |
Molecular Structure: | |
Formula: | C9H13NO4 |
Molecular Weight: | 199.2 |
Synonyms: | 1-(1,2-DIOXOPROPYL)-L-PROLINE, METHYL ESTER |
Density: | 1.227 g/cm3 |
Boiling Point: | 289.3 °C at 760 mmHg |
Flash Point: | 128.8 °C |
PSA: | 63.68000 |
LogP: | -0.32270 |
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The 1-(1,2-Dioxopropyl)-l-proline, methyl ester is an organic compound with the formula C9H13NO4. The systematic name of this chemical is methyl (2S)-1-(2-oxopropanoyl)pyrrolidine-2-carboxylate. With the CAS registry number 52060-75-0, it is also named as L-proline, 1-(1,2-dioxopropyl)-, methyl ester.
Physical properties about 1-(1,2-Dioxopropyl)-l-proline, methyl ester are: (1)#H bond acceptors: 5; (2)#Freely Rotating Bonds: 3; (3)Polar Surface Area: 63.68 Å2; (4)Index of Refraction: 1.488; (5)Molar Refractivity: 46.83 cm3; (6)Molar Volume: 162.2 cm3; (7)Polarizability: 18.56×10-24cm3; (8)Surface Tension: 45.3 dyne/cm; (9)Density: 1.227 g/cm3; (10)Flash Point: 128.8 °C; (11)Enthalpy of Vaporization: 52.86 kJ/mol; (12)Boiling Point: 289.3 °C at 760 mmHg; (13)Vapour Pressure: 0.00222 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC)[C@@H]1CCCN1C(=O)C(C)=O
(2)InChI: InChI=1/C9H13NO4/c1-6(11)8(12)10-5-3-4-7(10)9(13)14-2/h7H,3-5H2,1-2H3/t7-/m0/s1
(3)InChIKey: LTXZJVRPHRXAOT-ZETCQYMHBJ
(4)Std. InChI: InChI=1S/C9H13NO4/c1-6(11)8(12)10-5-3-4-7(10)9(13)14-2/h7H,3-5H2,1-2H3/t7-/m0/s1
(5)Std. InChIKey: LTXZJVRPHRXAOT-ZETCQYMHSA-N