1,2-Ethanediamine,N1-(2,4-dinitrophenyl)- supplier

Name
N1-(2,4-DINITRO-PHENYL)-ETHANE-1,2-DIAMINE
EINECS
CAS No. 28767-75-1
Article Data11
CAS DataBase
Density 1.48 g/cm³
Solubility
Melting Point
Formula C₈H₁₀N₄O₄
Boiling Point 429.6 °C at 760 mmHg
Molecular Weight 226.192
Flash Point 213.6 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1,2-Ethanediamine,N-(2,4-dinitrophenyl)- (9CI);Ethylenediamine, N-(2,4-dinitrophenyl)-(6CI,8CI);(2,4-Dinitrophenyl)ethylenediamine;N-(2,4-Dinitrophenyl)ethylenediamine;N-(2-Aminoethyl)-2,4-dinitroaniline;
PSA 129.69000
LogP 2.69330

1,2-Ethanediamine,N1-(2,4-dinitrophenyl)- Specification

This chemical is called 1,2-Ethanediamine,N1-(2,4-dinitrophenyl)-, and its systematic name is N-(2,4-dinitrophenyl)ethane-1,2-diamine. With the molecular formula of C₈H₁₀N₄O₄, its molecular weight is 226.19. The CAS registry number of this chemical is 28767-75-1.

Other characteristics of the 1,2-Ethanediamine,N1-(2,4-dinitrophenyl)- can be summarised as followings: (1)ACD/LogP: 1.68; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.28; (4)ACD/LogD (pH 7.4): 0.05; (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): 4.59; (9)#H bond acceptors: 8; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 98.12 Å²; (13)Index of Refraction: 1.67; (14)Molar Refractivity: 57.12 cm³; (15)Molar Volume: 152.7 cm³; (16)Polarizability: 22.64×10^-24cm³; (17)Surface Tension: 72.6 dyne/cm; (18)Density: 1.48 g/cm³; (19)Flash Point: 213.6 °C; (20)Enthalpy of Vaporization: 68.49 kJ/mol; (21)Boiling Point: 429.6 °C at 760 mmHg; (22)Vapour Pressure: 1.38E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: [O-][N+](=O)c1ccc(NCCN)c(c1)[N+]([O-])=O
2.InChI: InChI=1/C8H10N4O4/c9-3-4-10-7-2-1-6(11(13)14)5-8(7)12(15)16/h1-2,5,10H,3-4,9H2
3.InChIKey: AIUKPEQJKQUQKZ-UHFFFAOYAQ

Product Name

N1-(2,4-DINITRO-PHENYL)-ETHANE-1,2-DIAMINE

1,2-Ethanediamine,N1-(2,4-dinitrophenyl)- Specification

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