Product Name

  • Name

    H-TRP-ALA-OH

  • EINECS
  • CAS No. 24046-71-7
  • Article Data2
  • CAS DataBase
  • Density 1.338 g/cm3
  • Solubility
  • Melting Point
  • Formula C14H17N3O3
  • Boiling Point 629.8 °C at 760 mmHg
  • Molecular Weight 275.307
  • Flash Point 334.7 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes 22
  • Molecular Structure Molecular Structure of 24046-71-7 (H-TRP-ALA-OH)
  • Hazard Symbols Xn
  • Synonyms Alanine, N-L-tryptophyl- (7CI);Alanine, N-L-tryptophyl-, L-(8CI);L-Alanine, N-L-tryptophyl-;1881: PN: EP2071334 SEQID: 1984 claimed protein;1881: PN: WO2009077864 SEQID:1984 claimed protein;L-Tryptophanyl-L-alanine;L-Tryptophyl-L-alanine;NSC 97949;Tryptophanylalanine;Tryptophylalanine;
  • PSA 108.21000
  • LogP 1.71820

L-Alanine, L-tryptophyl- Specification

This chemical is called L-Alanine, L-tryptophyl-, and its systematic name is tryptophylalanine. With the molecular formula of C14H17N3O3, its molecular weight is 275.3. The CAS registry number of this chemical is 24046-71-7. Additionally, its product categorie is Amino Acid Derivatives. In addition, this chemical should be sealed at the temperature of -15 °C.

Other characteristics of the chemical can be summarised as followings:(1)ACD/LogP: 0.56; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): -1.94; (4)ACD/LogD (pH 7.4): -2.03; (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: 6; (12)Polar Surface Area: 54.78 Å2; (13)Index of Refraction: 1.652; (14)Molar Refractivity: 75.25 cm3; (15)Molar Volume: 205.7 cm3; (16)Polarizability: 29.83×10-24 cm3; (17)Surface Tension: 65.4 dyne/cm; (18)Density: 1.338 g/cm3; (19)Flash Point: 334.7 °C; (20)Enthalpy of Vaporization: 97.92 kJ/mol; (21)Boiling Point: 629.8 °C at 760 mmHg; (22)Vapour Pressure: 9.98E-17 mmHg at 25 °C.

You can still convert the following datas into molecular structure: 
1.SMILES: O=C(O)C(NC(=O)C(N)Cc2c1ccccc1nc2)C
2.InChI: InChI=1/C14H17N3O3/c1-8(14(19)20)17-13(18)11(15)6-9-7-16-12-5-3-2-4-10(9)12/h2-5,7-8,11,16H,6,15H2,1H3,(H,17,18)(H,19,20)
3.InChIKey: OHGNSVACHBZKSS-UHFFFAOYAL
4.Std. InChI: InChI=1S/C14H17N3O3/c1-8(14(19)20)17-13(18)11(15)6-9-7-16-12-5-3-2-4-10(9)12/h2-5,7-8,11,16H,6,15H2,1H3,(H,17,18)(H,19,20)
5.Std. InChIKey: OHGNSVACHBZKSS-UHFFFAOYSA-N

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