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CAS No.: | 62937-47-7 |
---|---|
Name: | Z-D-PRO-NH2 |
Article Data: | 12 |
Molecular Structure: | |
Formula: | C13H16N2O3 |
Molecular Weight: | 248.282 |
Synonyms: | 1-Pyrrolidinecarboxylicacid, 2-(aminocarbonyl)-, phenylmethyl ester, (R)- (9CI);Benzyl(R)-2-carbamoylpyrrolidine-1-carboxylate; |
Density: | 1.263 g/cm3 |
Melting Point: | 90-95 °C |
Boiling Point: | 465.6 °C at 760 mmHg |
Flash Point: | 235.4 °C |
Hazard Symbols: | Xi |
Risk Codes: | 36/37/38 |
Safety: | 26-36 |
PSA: | 72.63000 |
LogP: | 1.91110 |
The 1-Pyrrolidinecarboxylicacid, 2-(aminocarbonyl)-, phenylmethyl ester, (2R)-, with the CAS registry number of 62937-47-7, is also known as N-Alpha-carbobenzoxy-D-pyrrolidine-2-carboxylic acid amide and Z-D-Proline amide. It belongs to the product categories of Chiral; Chiral Reagent. This chemical's molecular formula is C13H16N2O3 and molecular weight is 248.28. What's more, its systematic name is called Benzyl (2R)-2-carbamoylpyrrolidine-1-carboxylate. Besides, it could be stored at room temperature.
Physical properties about are: (1)ACD/LogP: 0.23; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 5; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 49.85 Å2; (7)Index of Refraction: 1.581; (8)Molar Refractivity: 65.55 cm3; (9)Molar Volume: 196.5 cm3; (10)Polarizability: 25.98×10-24 cm3; (11)Surface Tension: 56.7 dyne/cm; (12)Density: 1.263 g/cm3; (13)Flash Point: 235.4 °C; (14)Enthalpy of Vaporization: 72.72 kJ/mol; (15)Boiling Point: 465.6 °C at 760 mmHg; (16)Melting Point: 90-95 °C; (17)Vapour Pressure: 7.61E-09 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
As a chemical, it is irritating to eyes, respiratory system and skin. During using it, wear suitable protective clothing. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1) SMILES: O=C(N)[C@@H]2N(C(=O)OCc1ccccc1)CCC2
(2) InChI: InChI=1/C13H16N2O3/c14-12(16)11-7-4-8-15(11)13(17)18-9-10-5-2-1-3-6-10/h1-3,5-6,11H,4,7-9H2,(H2,14,16)/t11-/m1/s1
(3) InChIKey: ZCGHEBMEQXMRQL-LLVKDONJBI