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CAS No.: | 121786-39-8 |
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Name: | D-CYCLOPROPYLALANINE |
Article Data: | 4 |
Molecular Structure: | |
Formula: | C6H11NO2 |
Molecular Weight: | 129.159 |
Synonyms: | Cyclopropanepropanoicacid, a-amino-, (R)- (9CI);D-3-(Cyclopropyl)alanine;(2R)-2-Ammonio-3-cyclopropylpropanoate; |
Density: | 1.218 g/cm3 |
Boiling Point: | 258.041 °C at 760 mmHg |
Flash Point: | 109.86 °C |
PSA: | 63.32000 |
LogP: | 0.89870 |
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The CAS registry number of D-Cyclopropylalanine is 121786-39-8. In addition, the molecular formula is C6H11NO2 and the molecular weight is 129.16. The systematic name is (2R)-2-ammonio-3-cyclopropylpropanoate. What's more, it can be used as an intermediate in synthesis of other amino acids. And it should be stored in a cool and dry place.
Physical properties about D-Cyclopropylalanine are: (1)ACD/LogP: 0.33; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 3; (7)#H bond donors: 3; (8)#Freely Rotating Bonds: 4; (9)Polar Surface Area: 67.77 Å2; (10)Index of Refraction: 1.532; (11)Molar Refractivity: 32.85 cm3; (12)Molar Volume: 105.9 cm3; (13)Polarizability: 13.02 ×10-24cm3; (14)Surface Tension: 57.7 dyne/cm; (15)Density: 1.218 g/cm3; (16)Flash Point: 109.86 °C; (17)Enthalpy of Vaporization: 54.566 kJ/mol; (18)Boiling Point: 258.041 °C at 760 mmHg; (19)Vapour Pressure: 0.004 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: [O-]C(=O)[C@H]([NH3+])CC1CC1
(2)Std.InChI: InChI=1S/C6H11NO2/c7-5(6(8)9)3-4-1-2-4/h4-5H,1-3,7H2,(H,8,9)/t5-/m1/s1
(3)Std.InChIKey: XGUXJMWPVJQIHI-RXMQYKEDSA-N