Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
4-Nitrophenylethylamine hydrobromide |
EINECS | N/A |
CAS No. | 69447-84-3 | Density | N/A |
PSA | 71.84000 | LogP | 3.27760 |
Solubility | N/A | Melting Point |
218 °C |
Formula | C8H10N2O2.BrH | Boiling Point | 340.9 °C at 760 mmHg |
Molecular Weight | 247.092 | Flash Point | 159.9 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
2-(4-Nnitrophenyl)ethan-1-amine hydrobromide;Benzeneethanamine,4-nitro-, monohydrobromide (9CI);4-Nitrophenylethylamine HBr; |
Article Data | 2 |
The 4-Nitrophenylethylamine hydrobromide with CAS registry number of 69447-84-3 is also known as 2-(4-Nnitrophenyl)ethan-1-amine hydrobromide. The IUPAC name is 1-(4-Nitrophenyl)ethanamine hydrobromide. In addition, the formula is C8H10N2O2.BrH and the molecular weight is 247.09.
Physical properties about 4-Nitrophenylethylamine hydrobromide are: (1)ACD/LogP: 1.19; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 4; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 71.84Å2; (7)Flash Point: 159.9 °C; (8)Enthalpy of Vaporization: 60.3 kJ/mol; (9)Boiling Point: 340.9 °C at 760 mmHg; (10)Vapour Pressure: 4.85E-05 mmHg at 25 °C
You can still convert the following datas into molecular structure:
1. SMILES: Br.NCCc1ccc(cc1)N(=O)=O
2. InChI: InChI=1/C8H10N2O2.BrH/c9-6-5-7-1-3-8(4-2-7)10(11)12;/h1-4H,5-6,9H2;1H
3. InChIKey: IXEDXMYYHOYVRD-UHFFFAOYAO