Product Name

  • Name

    1-Fmoc-3-amino-3-(hydroxymethyl)pyrrolidine

  • EINECS
  • CAS No. 951625-98-2
  • Density 1.27 g/cm3
  • Solubility
  • Melting Point
  • Formula C20H22N2O3
  • Boiling Point 527.2 °C at 760 mmHg
  • Molecular Weight 338.40
  • Flash Point 272.7 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 951625-98-2 (1-Fmoc-3-amino-3-(hydroxymethyl)pyrrolidine)
  • Hazard Symbols
  • Synonyms 1-pyrrolidinecarboxylic acid, 3-amino-3-(hydroxymethyl)-, 9H-fluoren-9-ylmethyl ester;
  • PSA 75.79000
  • LogP 2.96920

1-Fmoc-3-amino-3-(hydroxymethyl)pyrrolidine Specification

The 1-Fmoc-3-amino-3-(hydroxymethyl)pyrrolidine with the cas number 951625-98-2, is also called 1-pyrrolidinecarboxylic acid, 3-amino-3-(hydroxymethyl)-, 9H-fluoren-9-ylmethyl ester. The systematic name is 9H-fluoren-9-ylmethyl 3-amino-3-(hydroxymethyl)pyrrolidine-1-carboxylate. Its molecular formula is C20H22N2O3.

The properties of the chemical are: (1)ACD/LogP: 2.03; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 7.4): 0.74; (4)#H bond acceptors: 5; (5)#H bond donors: 3; (6)#Freely Rotating Bonds: 6; (7)Polar Surface Area: 75.79 Å2; (8)Index of Refraction: 1.627; (9)Molar Refractivity: 94.45 cm3; (10)Molar Volume: 266.3 cm3; (11)Polarizability: 37.44×10-24cm3; (12)Surface Tension: 55.9 dyne/cm; (13)Enthalpy of Vaporization: 84.4 kJ/mol; (14)Vapour Pressure: 6.04×10-12 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: NC1(CO)CCN(C1)C(=O)OCC4c2ccccc2c3ccccc34
(2)InChI: InChI=1/C20H22N2O3/c21-20(13-23)9-10-22(12-20)19(24)25-11-18-16-7-3-1-5-14(16)15-6-2-4-8-17(15)18/h1-8,18,23H,9-13,21H2

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