Product Name

  • Name

    N,N-DI-N-BUTYLETHYLENEDIAMINE

  • EINECS 222-558-6
  • CAS No. 3529-09-7
  • Article Data17
  • CAS DataBase
  • Density 0.842 g/cm3
  • Solubility
  • Melting Point 187-188 °C
  • Formula C10H24N2
  • Boiling Point 218.6 °C at 760 mmHg
  • Molecular Weight 172.314
  • Flash Point 87.8 °C
  • Transport Information UN 2735
  • Appearance
  • Safety 26-36/37/39-45
  • Risk Codes 34
  • Molecular Structure Molecular Structure of 3529-09-7 (N,N-DI-N-BUTYLETHYLENEDIAMINE)
  • Hazard Symbols R34:Causes burns.;
  • Synonyms 1,2-Ethanediamine,N,N-dibutyl- (9CI);Ethylenediamine, N,N-dibutyl- (6CI,7CI,8CI);2-(Dibutylamino)ethylamine;N,N-Dibutyl-1,2-ethanediamine;N,N-Dibutylethylenediamine;NSC 100948;
  • PSA 29.26000
  • LogP 2.54760

1,2-Ethanediamine,N1,N1-dibutyl- Specification

This chemical is called 1,2-Ethanediamine,N1,N1-dibutyl-, and its systematic name is . With the molecular formula of C10H24N2, its molecular weight is 172.31. The CAS registry number of this chemical is 3529-09-7. Additionally, this chemcial is also named as N,N-Dibutylethylenediamine.

Other characteristics of the 1,2-Ethanediamine,N1,N1-dibutyl- can be summarised as followings: (1)ACD/LogP: 2.34; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.6; (4)ACD/LogD (pH 7.4): -0.03; (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): 1.92; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 9; (12)Polar Surface Area: 6.48 Å2; (13)Index of Refraction: 1.456; (14)Molar Refractivity: 55.63 cm3; (15)Molar Volume: 204.5 cm3; (16)Polarizability: 22.05×10-24cm3; (17)Surface Tension: 31.5 dyne/cm; (18)Density: 0.842 g/cm3; (19)Flash Point: 87.8 °C; (20)Enthalpy of Vaporization: 45.5 kJ/mol; (21)Boiling Point: 218.6 °C at 760 mmHg; (22)Vapour Pressure: 0.125 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
1.SMILES: NCCN(CCCC)CCCC
2.InChI: InChI=1/C10H24N2/c1-3-5-8-12(10-7-11)9-6-4-2/h3-11H2,1-2H3
3.InChIKey: PWNDYKKNXVKQJO-UHFFFAOYAU

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