ETHYLENEDIAMINE MONOHYDRATE

The 1,2-Ethanediamine,monohydrate (9CI), with the CAS registry number 6780-13-8, is also known as 1,2-Ethanediamine, hydrate (1:1). It belongs to the product categories of Biochemistry; Reagents for Oligosaccharide Synthesis. This chemical's molecular formula is C₂H₁₀N₂O and molecular weight is 78.11. Its systematic name is called ethane-1,2-diamine hydrate (1:1).

Physical properties of 1,2-Ethanediamine,monohydrate (9CI): (1)# of Rule of 5 Violations: 1; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 3; (7)#H bond donors: 6; (8)#Freely Rotating Bonds: 3; (9)Flash Point: 97.6 °C; (10)Enthalpy of Vaporization: 53.24 kJ/mol; (11)Boiling Point: 237.8 °C at 760 mmHg; (12)Vapour Pressure: 0.012 mmHg at 25°C.

Uses of 1,2-Ethanediamine,monohydrate (9CI): it can be used to produce 4,6,8-trimethyl-2,3-dihydro-10-thia-1,3alpha,5,9-tetraaza-cyclopenta[a]fluorene by heating. This reaction will need solvent dioxane with reaction time of 5 hours. The yield is about 55%.

When you are using this chemical, please be cautious about it as the following:
This chemical is flammable. It is harmful by inhalation and in contact with skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection. In case of accident or if you feel unwell seek medical advice immediately (show the label where possible).

You can still convert the following datas into molecular structure:
(1)SMILES: O.NCCN
(2)InChI: InChI=1/C2H8N2.H2O/c3-1-2-4;/h1-4H2;1H2
(3)InChIKey: XZUAPPXGIFNDRA-UHFFFAOYAW