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L-3-Cyclopropylalanine

  • Name L-3-Cyclopropylalanine
  • EINECSN/A
  • CAS No. 102735-53-5
  • Density1.218 g/cm3
  • PSA63.32000
  • LogP0.89870
  • SolubilityN/A
  • Melting PointN/A
  • FormulaC6H11NO2
  • Boiling Point258 °C at 760 mmHg
  • Molecular Weight129.159
  • Flash Point109.9 °C
  • Transport InformationN/A
  • Appearancewhite crystalline powder
  • Safety
  • Risk Codes22
  • Molecular Structure
    Molecular Structure of 102735-53-5 (L-CYCLOPROPYLALANINE)
  • Hazard SymbolsXn
  • SynonymsXn
  • Article Data6

L-3-Cyclopropylalanine Specification

The CAS registry number of L-3-Cyclopropylalanine is 102735-53-5. Its EINECS registry number is 102735-53-5. In addition, the molecular formula is C6H11NO2 and the molecular weight is 129.16. The IUPAC name is (2S)-2-amino-3-cyclopropylpropanoic acid. What's more, it should be stored in sealed container, and put in a cool and dry place. And it is used as pharmaceutical intermediate or raw material in fine chemistry industry.

Physical properties about L-3-Cyclopropylalanine are: (1)ACD/LogP: 0.22; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 3; (7)#H bond donors: 3; (8)#Freely Rotating Bonds: 4; (9)Polar Surface Area: 37.3 Å2; (10)Index of Refraction: 1.532; (11)Molar Refractivity: 32.85 cm3; (12)Molar Volume: 105.9 cm3; (13)Polarizability: 13.02 ×10-24cm3; (14)Surface Tension: 57.7 dyne/cm; (15)Density: 1.218 g/cm3; (16)Flash Point: 109.9 °C; (17)Enthalpy of Vaporization: 54.57 kJ/mol; (18)Boiling Point: 258 °C at 760 mmHg; (19)Vapour Pressure: 0.00425 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: [O-]C(=O)[C@@H]([NH3+])CC1CC1
(2)Std.InChI: InChI=1S/C6H11NO2/c7-5(6(8)9)3-4-1-2-4/h4-5H,1-3,7H2,(H,8,9)/t5-/m0/s1
(3)Std.InChIKey: XGUXJMWPVJQIHI-YFKPBYRVSA-N

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