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CAS No.: | 71884-56-5 |
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Name: | D-Proline, 1-glycyl- (9CI) |
Molecular Structure: | |
Formula: | C7H12N2O3 |
Molecular Weight: | 172.184 |
Synonyms: | Glycyl-D-proline; |
Density: | 1.356 g/cm3 |
Boiling Point: | 411.309 °C at 760 mmHg |
Flash Point: | 202.552 °C |
PSA: | 83.63000 |
LogP: | -0.34110 |
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This chemical is called (R)-1-(2-Aminoacetyl)pyrrolidine-2-carboxylic acid, and its systematic name is glycyl-D-proline. With the molecular formula of C7H12N2O3, its molecular weight is 172.18. The CAS registry number of this chemical is 71884-56-5, and its product category is Pyrrole.
Other characteristics of the (R)-1-(2-Aminoacetyl)pyrrolidine-2-carboxylic acid can be summarised as followings: (1)ACD/LogP: -0.60; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -4; (4)ACD/LogD (pH 7.4): -4; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 5; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 83.63 Å2; (13)Index of Refraction: 1.557; (14)Molar Refractivity: 40.861 cm3; (15)Molar Volume: 126.955 cm3; (16)Polarizability: 16.199×10-24cm3; (17)Surface Tension: 66.213 dyne/cm; (18)Density: 1.356 g/cm3; (19)Flash Point: 202.552 °C; (20)Enthalpy of Vaporization: 72.824 kJ/mol; (21)Boiling Point: 411.309 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: O=C(O)[C@H]1CCC[N@]1C(=O)CN
2.InChI: InChI=1/C7H12N2O3/c8-4-6(10)9-3-1-2-5(9)7(11)12/h5H,1-4,8H2,(H,11,12)/t5-/m1/s1
3.InChIKey: KZNQNBZMBZJQJO-RXMQYKEDBA