| Identification | |
| Name: | D-Tyrosine, 3,5-diiodo- |
| Synonyms: | Tyrosine,3,5-diiodo-, D- (8CI);3,5-Diiodo-D-tyrosine;D-3,5-Diiodotyrosine;h-his(mtt)-oh;histidine(mtt)-oh; |
| CAS: | 16711-71-0 |
| Molecular Formula: | C9H9I2NO3 |
| Molecular Weight: | 469.44 |
| Molecular Structure: |  |
| Properties | |
| Density: | 2.405 |
| Specification: |
The 3,5-Diiodo-D-tyrosine with cas registry number of 16711-71-0, is also called Tyrosine,3,5-diiodo-, D- (8CI); D-3,5-Diiodotyrosine. Physical properties of 3,5-Diiodo-D-tyrosine: (1)ACD/LogP: 2.26; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.26; (4)ACD/LogD (pH 7.4): -0.74; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1.24; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 4; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 46.53 Å2; (13)Index of Refraction: 1.747; (14)Molar Refractivity: 73.18 cm3; (15)Molar Volume: 180 cm3; (16)Polarizability: 29.01×10-24cm3; (17)Surface Tension: 79.8 dyne/cm; (18)Enthalpy of Vaporization: 69.9 kJ/mol; (19)Vapour Pressure: 1.78E-07 mmHg at 25°C. You can still convert the following datas into molecular structure: (1)SMILES:Ic1cc(cc(I)c1O)C[C@H](C([O-])=O)[NH3+]; (2)InChI:InChI=1/C9H9I2NO3/c10-5-1-4(2-6(11)8(5)13)3-7(12)9(14)15/h1-2,7,13H,3,12H2,(H,14,15)/t7-/m1/s1; (3)InChIKey:NYPYHUZRZVSYKL-SSDOTTSWBX; (4)Std. InChI:InChI=1S/C9H9I2NO3/c10-5-1-4(2-6(11)8(5)13)3-7(12)9(14)15/h1-2,7,13H,3,12H2,(H,14,15)/t7-/m1/s1; (5)Std. InChIKey:NYPYHUZRZVSYKL-SSDOTTSWSA-N. |
| Storage Temperature: | -15°C |
| Safety Data | |
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