Product Name

  • Name

    (3S,4R)-4-(2-FLUOROPHENYL)PYRROLIDINE-3-CARBOXYLIC ACID

  • EINECS
  • CAS No. 1049975-91-8
  • Density
  • Solubility
  • Melting Point
  • Formula C11H12 F N O2
  • Boiling Point
  • Molecular Weight 209.21700
  • Flash Point
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 1049975-91-8 ((3S,4R)-4-(2-FLUOROPHENYL)PYRROLIDINE-3-CARBOXYLIC ACID)
  • Hazard Symbols
  • Synonyms (3S,4R)-4-(2-FLUOROPHENYL)PYRROLIDINE-3-CARBOXYLIC ACID;3-Pyrrolidinecarboxylic acid, 4-(2-fluorophenyl)-, (3S,4R)-
  • PSA 49.33000
  • LogP 1.54210

(3S,4R)-4-(2-Fluorophenyl)pyrrolidine-3-carboxylic acid Chemical Properties

Molecule structure of (3S,4R)-4-(2-Fluorophenyl)pyrrolidine-3-carboxylic acid (CAS NO.1049975-91-8):

Product Name: (3S,4R)-4-(2-Fluorophenyl)pyrrolidine-3-carboxylic acid
Molecular Formula: C11H12FNO2
Molecular Weight: 209.22 g/mol 
CAS Registry Number: 1049975-91-8 
Index of Refraction: 1.545
Molar Refractivity: 52.34 cm3
Molar Volume: 165.3 cm3
Polarizability: 20.74×10-24 cm3
Surface Tension: 44.9 dyne/cm
Density: 1.264 g/cm3
Flash Point: 166.1 °C
Enthalpy of Vaporization: 62.86 kJ/mol
Boiling Point: 351 °C at 760 mmHg
Vapour Pressure: 1.57E-05 mmHg at 25 °C 
SMILES: O=C(O)[C@H]2[C@H](c1c(F)cccc1)CNC2 
InChI: InChI=1/C11H12FNO2/c12-10-4-2-1-3-7(10)8-5-13-6-9(8)11(14)15/h1-4,8-9,13H,5-6H2,(H,14,15)/t8-,9+/m0/s1 
InChIKey: YVTADGCUSGBFIQ-DTWKUNHWBN
Std. InChI: InChI=1S/C11H12FNO2/c12-10-4-2-1-3-7(10)8-5-13-6-9(8)11(14)15/h1-4,8-9,13H,5-6H2,(H,14,15)/t8-,9+/m0/s1 
Std. InChIKey of (3S,4R)-4-(2-Fluorophenyl)pyrrolidine-3-carboxylic acid (CAS NO.1049975-91-8): YVTADGCUSGBFIQ-DTWKUNHWSA-N

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