Product Name

  • Name

    N~2~-(diphenylphosphorothioyl)asparagine

  • EINECS
  • CAS No. 61058-04-6
  • Density 1.37 g/cm3
  • Solubility
  • Melting Point
  • Formula C16H17N2O3PS
  • Boiling Point 601.7 °C at 760 mmHg
  • Molecular Weight 348.362
  • Flash Point 317.7 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 61058-04-6 (N~2~-(diphenylphosphorothioyl)asparagine)
  • Hazard Symbols
  • Synonyms NSC 289755;
  • PSA
  • LogP

L-Asparagine, N2-(diphenylphosphinothioyl)- Specification

This chemical is called L-Asparagine, N2-(diphenylphosphinothioyl)-, and its CAS registry number is 61058-04-6. With the molecular formula of C16H17N2O3PS, its molecular weight is 348.36.

Other characteristics of the L-Asparagine, N2-(diphenylphosphinothioyl)- can be summarised as followings: (1)ACD/LogP: 1.33; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 5; (4)#H bond donors: 4; (5)#Freely Rotating Bonds: 6; (6)Polar Surface Area: 91.75 Å2; (7)Index of Refraction: 1.653; (8)Molar Refractivity: 92.74 cm3; (9)Molar Volume: 253 cm3; (10)Polarizability: 36.76×10-24cm3; (11)Surface Tension: 70.7 dyne/cm; (12)Density: 1.37 g/cm3; (13)Flash Point: 317.7 °C; (14)Enthalpy of Vaporization: 94.15 kJ/mol; (15)Boiling Point: 601.7 °C at 760 mmHg; (16)Vapour Pressure: 2.49E-15 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
1.SMILES: S=P(NC(C(=O)O)CC(=O)N)(c1ccccc1)c2ccccc2
2.InChI: InChI=1/C16H17N2O3PS/c17-15(19)11-14(16(20)21)18-22(23,12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,14H,11H2,(H2,17,19)(H,18,23)(H,20,21)
3.InChIKey: UTTKSDZEFKYVBQ-UHFFFAOYAM

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