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Name |
DL-Alanyl-L-alanine |
EINECS | N/A |
CAS No. | 59247-16-4 | Density | 1.208 g/cm3 |
PSA | 92.42000 | LogP | 0.01410 |
Solubility | almost transparency | Melting Point |
N/A |
Formula | C6H12N2O3 | Boiling Point | 402.648 °C at 760 mmHg |
Molecular Weight | 160.173 | Flash Point | 197.315 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
Alanyl-L-alanine;(2S)-2-(2-Aminopropanoylamino)propanoic acid; |
The DL-Alanyl-L-alanine, with the CAS registry number 59247-16-4, is also known as Alanyl-L-alanine. It belongs to the product categories of Biochemistry; Oligopeptides; Peptide Synthesis. This chemical's molecular formula is C6H12N2O3 and molecular weight is 160.17. What's more, its systematic name is (2S)-2-(2-Aminopropanoylamino)propanoic acid. It should be sealed and stored in a cool and dry place and be protected from water.
Physical properties of DL-Alanyl-L-alanine are: (1)# of Rule of 5 Violations: 0; (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: 5; (7)#H bond donors: 4; (8)#Freely Rotating Bonds: 4; (9)Polar Surface Area: 92.42 Å2; (10)Index of Refraction: 1.492; (11)Molar Refractivity: 38.488 cm3; (12)Molar Volume: 132.568 cm3; (13)Polarizability: 15.258×10-24 cm3; (14)Surface Tension: 48.3 dyne/cm; (15)Density: 1.208 g/cm3; (16)Flash Point: 197.315 °C; (17)Enthalpy of Vaporization: 71.749 kJ/mol; (18)Boiling Point: 402.648 °C at 760 mmHg; (19)Vapour Pressure: 0 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES: C[C@@H](C(=O)O)NC(=O)C(C)N
(2)InChI: InChI=1/C6H12N2O3/c1-3(7)5(9)8-4(2)6(10)11/h3-4H,7H2,1-2H3,(H,8,9)(H,10,11)/t3?,4-/m0/s1
(3)InChIKey: DEFJQIDDEAULHB-BKLSDQPFBB