Product Name

  • Name

    1-(3',4'-DIFLUOROPHENYL)ETHYLAMINE

  • EINECS
  • CAS No. 276875-21-9
  • Article Data7
  • CAS DataBase
  • Density 1.163 g/cm3
  • Solubility
  • Melting Point
  • Formula C8H9F2N
  • Boiling Point 186.1 °C at 760 mmHg
  • Molecular Weight 157.163
  • Flash Point 81.4 °C
  • Transport Information 2735
  • Appearance
  • Safety 26-36/37/39
  • Risk Codes 34
  • Molecular Structure Molecular Structure of 276875-21-9 (1-(3',4'-DIFLUOROPHENYL)ETHYLAMINE)
  • Hazard Symbols Xn
  • Synonyms 1-(3,4-Difluorophenyl)-1-ethanamine;1-(3,4-Difluorophenyl)ethylamine;Benzenemethanamine, 3,4-difluoro-alpha-methyl- (9CI);
  • PSA 26.02000
  • LogP 2.68480

Benzenemethanamine,3,4-difluoro-a-methyl- Specification

The CAS register number of Benzenemethanamine,3,4-difluoro-a-methyl- is 276875-21-9. It also can be called as 1-(3,4-Difluorophenyl)-1-ethanamine and the IUPAC name about this chemical is 1-(3,4-difluorophenyl)ethanamine. The molecular formula about this chemical is C8H9F2N and the molecular weight is 157.16. It belongs to the following product categories which include Halide; Anilines, Amides & Amines; Fluorine Compounds and so on.

Physical properties about Benzenemethanamine,3,4-difluoro-a-methyl- are: (1)ACD/LogP: 1.45; (2)#H bond acceptors: 1; (3)#H bond donors: 2; (4)#Freely Rotating Bonds: 2; (5)Polar Surface Area: 3.24 Å2; (6)Index of Refraction: 1.493; (7)Molar Refractivity: 39.32 cm3; (8)Molar Volume: 135 cm3; (9)Polarizability: 15.59x10-24cm3; (10)Surface Tension: 33.8 dyne/cm; (11)Density: 1.163 g/cm3; (12)Flash Point: 81.4 °C; (13)Enthalpy of Vaporization: 42.23 kJ/mol; (14)Boiling Point: 186.1 °C at 760 mmHg; (15)Vapour Pressure: 0.676 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
This chemical can cause burns. If you want to use it, wear suitable protective clothing, gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc1ccc(cc1F)C(N)C
(2)InChI: InChI=1/C8H9F2N/c1-5(11)6-2-3-7(9)8(10)4-6/h2-5H,11H2,1H3
(3)InChIKey: AESHLRAPTJZOJL-UHFFFAOYAO
(4)Std. InChI: InChI=1S/C8H9F2N/c1-5(11)6-2-3-7(9)8(10)4-6/h2-5H,11H2,1H3
(5)Std. InChIKey: AESHLRAPTJZOJL-UHFFFAOYSA-N

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