Product Name

  • Name

    3-[(1R)-1-(Dimethylamino)ethyl]phenol

  • EINECS
  • CAS No. 851086-95-8
  • Article Data3
  • CAS DataBase
  • Density 1.021 g/cm3
  • Solubility
  • Melting Point
  • Formula C10H15NO
  • Boiling Point 241.3 °C at 760 mmHg
  • Molecular Weight 165.235
  • Flash Point 97.2 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 851086-95-8 (3-[(1R)-1-(Dimethylamino)ethyl]phenol)
  • Hazard Symbols
  • Synonyms 3-[(1R)-1-(Dimethylamino)ethyl]phenol;ent NAP 226-90;3-((R)-1-DiMethylaMino-ethyl)phenol;(R)-3-(1-N,N-DiMethylaMinoethyl)]phenol;Phenol, 3-[(1R)-1-(dimethylamino)ethyl]-
  • PSA 23.47000
  • LogP 2.01480

3-[(1R)-1-(Dimethylamino)ethyl]phenol Specification

This chemical is called 3-[(1R)-1-(Dimethylamino)ethyl]phenol, and it can also be named as phenol, 3-[(1R)-1-(dimethylamino)ethyl]-. With the molecular formula of C10H15NO, its molecular weight is 165.23. The CAS registry number of this chemical is 851086-95-8, and its product categories are Chiral Reagents; Intermediates & Fine Chemicals; Metabolites & Impurities; Pharmaceuticals.

Other characteristics of the 3-[(1R)-1-(Dimethylamino)ethyl]phenol can be summarised as followings: (1)ACD/LogP: 1.59; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.32; (4)ACD/LogD (pH 7.4): 0.12; (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): 5.94; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 12.47 Å2; (13)Index of Refraction: 1.539; (14)Molar Refractivity: 50.67 cm3; (15)Molar Volume: 161.6 cm3; (16)Polarizability: 20.08×10-24cm3; (17)Surface Tension: 38.5 dyne/cm; (18)Density: 1.021 g/cm3; (19)Flash Point: 97.2 °C; (20)Enthalpy of Vaporization: 49.77 kJ/mol; (21)Boiling Point: 241.3 °C at 760 mmHg; (22)Vapour Pressure: 0.0233 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
1.SMILES: Oc1cc(ccc1)[C@H](N(C)C)C
2.InChI: InChI=1/C10H15NO/c1-8(11(2)3)9-5-4-6-10(12)7-9/h4-8,12H,1-3H3/t8-/m1/s1
3.InChIKey: GQZXRLWUYONVCP-MRVPVSSYBB

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