Product Name

  • Name

    FMOC-D-ALLO-THR-OH

  • EINECS
  • CAS No. 130674-54-3
  • Article Data6
  • CAS DataBase
  • Density 1.327g/cm3
  • Solubility
  • Melting Point
  • Formula C19H19NO5
  • Boiling Point 596.5 °C at 760 mmHg
  • Molecular Weight 341.364
  • Flash Point 314.6 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 130674-54-3 (FMOC-D-ALLO-THR-OH)
  • Hazard Symbols
  • Synonyms Fmoc-D-allo-threonine;
  • PSA 95.86000
  • LogP 2.75000

D-Allothreonine,N-[(9H-fluoren-9-ylmethoxy)carbonyl]- Specification

The D-Allothreonine,N-[(9H-fluoren-9-ylmethoxy)carbonyl]-, with CAS registry number 130674-54-3, belongs to the following product category: Amino Acids. It has the systematic name of N-[(9H-fluoren-9-ylmethoxy)carbonyl]-L-allothreonine. This chemical should be stored at room temperature. And the chemical formula of this chemical is C19H19NO5.

Physical properties of D-Allothreonine,N-[(9H-fluoren-9-ylmethoxy)carbonyl]-: (1)ACD/LogP: 3.01; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 6; (4)#H bond donors: 3; (5)#Freely Rotating Bonds: 7; (6)Polar Surface Area: 65.07 Å2; (7)Index of Refraction: 1.617; (8)Molar Refractivity: 90.04 cm3; (9)Molar Volume: 257.1 cm3; (10)Polarizability: 35.69×10-24cm3; (11)Surface Tension: 60.1 dyne/cm; (12)Density: 1.327 g/cm3; (13)Flash Point: 314.6 °C; (14)Enthalpy of Vaporization: 93.46 kJ/mol; (15)Boiling Point: 596.5 °C at 760 mmHg; (16)Vapour Pressure: 4.45E-15 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)[C@@H](NC(=O)OCC3c1ccccc1c2c3cccc2)[C@@H](O)C
(2)InChI: InChI=1/C19H19NO5/c1-11(21)17(18(22)23)20-19(24)25-10-16-14-8-4-2-6-12(14)13-7-3-5-9-15(13)16/h2-9,11,16-17,21H,10H2,1H3,(H,20,24)(H,22,23)/t11-,17-/m0/s1
(3)InChIKey: OYULCCKKLJPNPU-GTNSWQLSBL
(4)Std. InChI: InChI=1S/C19H19NO5/c1-11(21)17(18(22)23)20-19(24)25-10-16-14-8-4-2-6-12(14)13-7-3-5-9-15(13)16/h2-9,11,16-17,21H,10H2,1H3,(H,20,24)(H,22,23)/t11-,17-/m0/s1
(5)Std. InChIKey: OYULCCKKLJPNPU-GTNSWQLSSA-N

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