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CAS No.: | 50632-89-8 |
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Name: | H-GLY-D-TRP-OH |
Molecular Structure: | |
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Formula: | C13H15N3O3 |
Molecular Weight: | 261.28 |
Synonyms: | D-Tryptophan,N-glycyl- (9CI);D-Glycyltryptophan;Glycyl-D-tryptophan; |
Density: | 1.383 g/cm3 |
Boiling Point: | 621.8 °C at 760 mmHg |
Flash Point: | 329.9 °C |
PSA: | 108.21000 |
LogP: | 1.32970 |
The D-Tryptophan, glycyl-, with the CAS registry number 50632-89-8, is also known as 2-(2-Amino-acetylamino)-3-(1H-indol-3-yl)-propionic acid. This chemical's molecular formula is C13H15N3O3 and molecular weight is 261.28. What's more, its systematic name is Glycyltryptophan.
Physical properties of D-Tryptophan, glycyl- are: (1)ACD/LogP: 0.26; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): -2.23; (4)ACD/LogD (pH 7.4): -2.46; (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: 6; (10)#H bond donors: 5; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 54.78 Å2; (13)Index of Refraction: 1.671; (14)Molar Refractivity: 70.65 cm3; (15)Molar Volume: 188.8 cm3; (16)Polarizability: 28.01×10-24 cm3; (17)Surface Tension: 70.8 dyne/cm; (18)Density: 1.383 g/cm3; (19)Flash Point: 329.9 °C; (20)Enthalpy of Vaporization: 96.85 kJ/mol; (21)Boiling Point: 621.8 °C at 760 mmHg; (22)Vapour Pressure: 2.52E-16 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES:O=C(O)C(NC(=O)CN)Cc2c1ccccc1nc2
(2)InChI:InChI=1/C13H15N3O3/c14-6-12(17)16-11(13(18)19)5-8-7-15-10-4-2-1-3-9(8)10/h1-4,7,11,15H,5-6,14H2,(H,16,17)(H,18,19)
(3)InChIKey:AJHCSUXXECOXOY-UHFFFAOYAW