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L-Tyrosine, L-alanyl-

  • Name L-Tyrosine, L-alanyl-
  • EINECS221-305-7
  • CAS No. 3061-88-9
  • Density1.315 g/cm3
  • PSA112.65000
  • LogP0.94250
  • Solubility17.99g/L at 20℃
  • Melting Point238-240℃ (decomposition)
  • FormulaC12H16N2O4
  • Boiling Point558 °C at 760 mmHg
  • Molecular Weight252.27
  • Flash Point291.2 °C
  • Transport InformationN/A
  • AppearanceWhite crystalline powder
  • Safety
  • Risk CodesN/A
  • Molecular Structure
    Molecular Structure of 3061-88-9 (L-ALANYL-L-TYROSINE)
  • Hazard SymbolsN/A
  • SynonymsN/A
  • Article Data5

L-Tyrosine, L-alanyl- Specification

The L-Tyrosine, L-alanyl-, with CAS registry number 3061-88-9, belongs to the following product categories: (1)Biochemistry; (2)Oligopeptides; (3)Peptide Synthesis; (4)Dipeptides; (5)Dipeptides and Tripeptides; (6)Peptides. It has the systematic name of L-alanyl-L-tyrosine. This chemical should be stored at the temperature of −20°C. And the chemical formula of this chemical is C12H16N2O4. What's more, its EINECS is 221-305-7.

Physical properties of L-Tyrosine, L-alanyl-: (1)ACD/LogP: -0.05; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): -2.55; (4)ACD/LogD (pH 7.4): -2.63; (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: 7; (12)Polar Surface Area: 59.08 Å2; (13)Index of Refraction: 1.591; (14)Molar Refractivity: 64.85 cm3; (15)Molar Volume: 191.6 cm3; (16)Polarizability: 25.71×10-24cm3; (17)Surface Tension: 61.4 dyne/cm; (18)Density: 1.315 g/cm3; (19)Flash Point: 291.2 °C; (20)Enthalpy of Vaporization: 88.37 kJ/mol; (21)Boiling Point: 558 °C at 760 mmHg; (22)Vapour Pressure: 2.76E-13 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)[C@@H](NC(=O)[C@@H](N)C)Cc1ccc(O)cc1
(2)InChI: InChI=1/C12H16N2O4/c1-7(13)11(16)14-10(12(17)18)6-8-2-4-9(15)5-3-8/h2-5,7,10,15H,6,13H2,1H3,(H,14,16)(H,17,18)/t7-,10-/m0/s1
(3)InChIKey: ALZVPLKYDKJKQU-XVKPBYJWBS
(4)Std. InChI: InChI=1S/C12H16N2O4/c1-7(13)11(16)14-10(12(17)18)6-8-2-4-9(15)5-3-8/h2-5,7,10,15H,6,13H2,1H3,(H,14,16)(H,17,18)/t7-,10-/m0/s1
(5)Std. InChIKey: ALZVPLKYDKJKQU-XVKPBYJWSA-N

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