Product Name

  • Name

    Z-ASN(TRT)-OH

  • EINECS
  • CAS No. 132388-57-9
  • Article Data4
  • CAS DataBase
  • Density 1.253 g/cm3
  • Solubility
  • Melting Point
  • Formula C31H28N2O5
  • Boiling Point 775.979 °C at 760 mmHg
  • Molecular Weight 508.574
  • Flash Point 423.097 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 132388-57-9 (Z-ASN(TRT)-OH)
  • Hazard Symbols
  • Synonyms Z-Asn(Trt)-OH;(S)-2-(Benzyloxycarbonylamino)-4-oxo-4-(tritylamino)butanoic acid;
  • PSA 104.73000
  • LogP 5.64620

N-Cbz-N'-trityl-L-asparagine Specification

The L-Asparagine,N2-[(phenylmethoxy)carbonyl]-N-(triphenylmethyl)-, with the CAS registry number 132388-57-9, is also known as Z-Asn(Trt)-OH and (S)-2-(Benzyloxycarbonylamino)-4-oxo-4-(tritylamino)butanoic acid. It belongs to the product category of Asparagine [Asn, N]. This chemical's molecular formula is C31H28N2O5 and molecular weight is 508.56. What's more, its systematic name is called (2S)-2-(Benzyloxycarbonylamino)-4-oxo-4-(tritylamino)butanoic acid.

Physical properties about L-Asparagine,N2-[(phenylmethoxy)carbonyl]-N-(triphenylmethyl)- are: (1)ACD/LogP: 5.25; (2)# of Rule of 5 Violations: 2; (3)ACD/LogD (pH 5.5): 3.049; (4)ACD/LogD (pH 7.4): 1.66; (5)ACD/BCF (pH 5.5): 36.1; (6)ACD/BCF (pH 7.4): 1.476; (7)ACD/KOC (pH 5.5): 107.037; (8)ACD/KOC (pH 7.4): 4.375; (9)#H bond acceptors: 7; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 11; (12)Polar Surface Area: 104.73 Å2; (13)Index of Refraction: 1.619; (14)Molar Refractivity: 142.339 cm3; (15)Molar Volume: 405.762 cm3; (16)Surface Tension: 54.047 dyne/cm; (17)Density: 1.253 g/cm3; (18)Flash Point: 423.097 °C; (19)Enthalpy of Vaporization: 118.471 kJ/mol; (20)Boiling Point: 775.979 °C at 760 mmHg; (21)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: c1ccc(cc1)COC(=O)N[C@@H](CC(=O)NC(c2ccccc2)(c3ccccc3)c4ccccc4)C(=O)O
(2) InChI: InChI=1/C31H28N2O5/c34-28(21-27(29(35)36)32-30(37)38-22-23-13-5-1-6-14-23)33-31(24-15-7-2-8-16-24,25-17-9-3-10-18-25)26-19-11-4-12-20-26/h1-20,27H,21-22H2,(H,32,37)(H,33,34)(H,35,36)/t27-/m0/s1
(3) InChIKey: FPVBKISSJULIGI-MHZLTWQEBS

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