Basic Information | Post buying leads | Suppliers |
Name |
Fmoc-2,6-dimethyl-L-tyrosine |
EINECS | N/A |
CAS No. | 206060-54-0 | Density | 1.29 g/cm3 |
PSA | 99.35000 | LogP | 4.74780 |
Solubility | N/A | Melting Point |
N/A |
Formula | C26H25NO5 | Boiling Point | 691.229 °C at 760 mmHg |
Molecular Weight | 431.48 | Flash Point | 371.842 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
N-[(9H-Fluoren-9-ylmethoxy)carbonyl]-2,6-dimethyl-L-tyrosine; |
The systematic name of Fmoc-2,6-dimethyl-L-tyrosine is (2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(4-hydroxy-2,6-dimethyl-phenyl)propanoic acid. With the CAS registry number 206060-54-0, it is also named as N-[(9H-Fluoren-9-ylmethoxy)carbonyl]-2,6-dimethyl-L-tyrosine. In addition, its molecular formula is C26H25NO5 and molecular weight is 431.48.
The other characteristics of Fmoc-2,6-dimethyl-L-tyrosine can be summarized as: (1)ACD/LogP: 4.24; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.801; (4)ACD/LogD (pH 7.4): 0.585; (5)ACD/BCF (pH 5.5): 3.574; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 17.552; (8)ACD/KOC (pH 7.4): 1.068; (9)#H bond acceptors: 6; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 95.86 Å2; (13)Index of Refraction: 1.636; (14)Molar Refractivity: 119.933 cm3; (15)Molar Volume: 334.407 cm3; (16)Polarizability: 47.545×10-24cm3; (17)Surface Tension: 58.429 dyne/cm; (18)Density: 1.29 g/cm3; (19)Flash Point: 371.842 °C; (20)Enthalpy of Vaporization: 106.38 kJ/mol; (21)Boiling Point: 691.229 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25 °C.
People can use the following data to convert to the molecule structure.
(1)SMILES: Cc1cc(cc(c1C[C@H](C(=O)O)NC(=O)OCC2c3ccccc3-c4c2cccc4)C)O
(2)InChI: InChI=1/C26H25NO5/c1-15-11-17(28)12-16(2)22(15)13-24(25(29)30)27-26(31)32-14-23-20-9-5-3-7-18(20)19-8-4-6-10-21(19)23/h3-12,23-24,28H,13-14H2,1-2H3,(H,27,31)(H,29,30)/t24-/m1/s1
(3)InChIKey: RHSSAHKTHNKPGU-XMMPIXPABN