Product Name

  • Name

    (R)-alpha,alpha-Diphenylmethylprolinol

  • EINECS -0
  • CAS No. 144119-12-0
  • Article Data1
  • CAS DataBase
  • Density 1.116 g/cm3
  • Solubility
  • Melting Point 68-71 °C
  • Formula C18H21NO
  • Boiling Point 406.791 °C at 760 mmHg
  • Molecular Weight 267.3654
  • Flash Point 196.766 °C
  • Transport Information
  • Appearance white to off-white crystalline powder
  • Safety 26-36
  • Risk Codes 36/37/38
  • Molecular Structure Molecular Structure of 144119-12-0 ((R)-alpha,alpha-Diphenylmethylprolinol)
  • Hazard Symbols IrritantXi
  • Synonyms 2-Pyrrolidinemethanol,1-methyl-a,a-diphenyl-, (R)-;(R)-N-Methyl-a,a-diphenylprolinol;
  • PSA 23.47000
  • LogP 2.95460

Diphenyl-N-methyl-D-prolinol Specification

The IUPAC name of Diphenyl-N-methyl-D-prolinol is [(2R)-1-methylpyrrolidin-1-ium-2-yl]-diphenylmethanol. With the CAS registry number 144119-12-0, it is also named as 1,1,1-Diphenyl-(N-methyl-pyrroline-2yl)-methanol; 2-Pyrrolidinemethanol, 1-methyl-alpha,alpha-diphenyl-, (2S)-. The product's categories are asymmetric synthesis and synthetic organic chemistry. It is white to off-white crystalline powder which can be used as pharmaceutical intermediates. This chemical must be stored at the temperature of 0-6°C and avoid direct sunshine.

The other characteristics of this product can be summarized as: (1)ACD/LogP: 4.03; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 4; (6)Index of Refraction: 1.595; (7)Molar Refractivity: 81.39 cm3; (8)Molar Volume: 239.5 cm3; (9)Polarizability: 32.26×10-24 cm3; (10)Surface Tension: 46.6 dyne/cm; (11)Enthalpy of Vaporization: 69.44 kJ/mol; (12)Vapour Pressure: 2.39E-07 mmHg at 25°C; (13)Rotatable Bond Count: 3; (14)Exact Mass: 268.170139; (15)MonoIsotopic Mass: 268.170139; (16)Topological Polar Surface Area: 24.7; (17)Heavy Atom Count: 20; (18)Formal Charge: 1; (19)Complexity: 287.

When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. If you want to contact this product, you must wear suitable protective clothing.

People can use the following data to convert to the molecule structure.
1. SMILES: OC(c1ccccc1)(c2ccccc2)[C@H]3N(C)CCC3;
2. InChI: InChI=1/C18H21NO/c1-19-14-8-13-17(19)18(20,15-9-4-2-5-10-15)16-11-6-3-7-12-16/h2-7,9-12,17,20H,8,13-14H2,1H3/t17-/m0/s1.

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