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CAS No.: | 3422-39-7 |
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Name: | H-GLU-TYR-OH |
Molecular Structure: | |
Formula: | C14H18N2O6 |
Molecular Weight: | 310.307 |
Synonyms: | L-Tyrosine,N-L-a-glutamyl-;Tyrosine, N-L-a-glutamyl-, L- (6CI,8CI);L-Glutamyl-L-tyrosine;L-a-Glutamyl-L-tyrosine;NSC 523821; |
Density: | 1.414 g/cm3 |
Boiling Point: | 692.1 °C at 760 mmHg |
Flash Point: | 372.3 °C |
PSA: | 149.95000 |
LogP: | 0.78740 |
The L-Tyrosine, L-a-glutamyl-, with CAS registry number 3422-39-7, has the systematic name of L-α-glutamyl-D-tyrosine. Besides this, it is also called H-GLU-TYR-OH. This chemical should be stored at the temperature of -15°C. And the chemical formula of this chemical is C14H18N2O6.
Physical properties of L-Tyrosine, L-a-glutamyl-: (1)ACD/LogP: -0.16; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): -3.53; (4)ACD/LogD (pH 7.4): -3.73; (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: 8; (10)#H bond donors: 6; (11)#Freely Rotating Bonds: 10; (12)Polar Surface Area: 85.38 Å2; (13)Index of Refraction: 1.606; (14)Molar Refractivity: 75.68 cm3; (15)Molar Volume: 219.3 cm3; (16)Polarizability: 30×10-24cm3; (17)Surface Tension: 71.5 dyne/cm; (18)Density: 1.414 g/cm3; (19)Flash Point: 372.3 °C; (20)Enthalpy of Vaporization: 106.5 kJ/mol; (21)Boiling Point: 692.1 °C at 760 mmHg; (22)Vapour Pressure: 4.15E-20 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)CC[C@H](N)C(=O)N[C@@H](C(=O)O)Cc1ccc(O)cc1
(2)InChI: InChI=1/C14H18N2O6/c15-10(5-6-12(18)19)13(20)16-11(14(21)22)7-8-1-3-9(17)4-2-8/h1-4,10-11,17H,5-7,15H2,(H,16,20)(H,18,19)(H,21,22)/t10-,11+/m0/s1
(3)InChIKey: YSWHPLCDIMUKFE-WDEREUQCBH
(4)Std. InChI: InChI=1S/C14H18N2O6/c15-10(5-6-12(18)19)13(20)16-11(14(21)22)7-8-1-3-9(17)4-2-8/h1-4,10-11,17H,5-7,15H2,(H,16,20)(H,18,19)(H,21,22)/t10-,11+/m0/s1
(5)Std. InChIKey: YSWHPLCDIMUKFE-WDEREUQCSA-N