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CAS No.: | 206559-45-7 |
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Name: | 4-BROMOPHENETHYLAMINE HYDROBROMIDE |
Molecular Structure: | |
Formula: | C8H11Br2N |
Molecular Weight: | 280.99 |
Synonyms: | Benzeneethanamine,4-bromo-, hydrobromide (9CI);2-(4-Bromophenyl)ethylamine hydrobromide;4-Bromophenylethylamine hydrobromide; |
Melting Point: | 272 °C |
Boiling Point: | 271.3 °C at 760 mmHg |
Flash Point: | 113.1 °C |
Hazard Symbols: | Xi,C |
PSA: | 26.02000 |
LogP: | 3.60870 |
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The CAS register number of Benzeneethanamine,4-bromo-, hydrobromide (1:1) is 206559-45-7. It also can be called as 4-Bromophenylethylamine hydrobromide and the IUPAC name about this chemical is 2-(4-bromophenyl)ethanamine hydrobromide. The molecular formula about this chemical is C8H11Br2N and the molecular weight is 280.99. It belongs to the following product categories which include Anilines, Aromatic Amines and Nitro Compounds. This chemical is irritant and corrosive. It may cause inflammation to the skin or other mucous membranes and destroy living tissue on contact.
Physical properties about Benzeneethanamine,4-bromo-, hydrobromide (1:1) are: (1)ACD/LogP: 2.23; (2)ACD/LogD (pH 5.5): -0.84; (3)ACD/LogD (pH 7.4): -0.02; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 2.18; (8)#H bond acceptors: 1; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 3; (11)Flash Point: 113.1 °C; (12)Enthalpy of Vaporization: 50.95 kJ/mol; (13)Boiling Point: 271.3 °C at 760 mmHg; (14)Vapour Pressure: 0.00649 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES: [Br-].Brc1ccc(cc1)CC[NH3+]
(2)InChI: InChI=1/C8H10BrN.BrH/c9-8-3-1-7(2-4-8)5-6-10;/h1-4H,5-6,10H2;1H
(3)InChIKey: IUWPMHYAMOUYKQ-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C8H10BrN.BrH/c9-8-3-1-7(2-4-8)5-6-10;/h1-4H,5-6,10H2;1H
(5)Std. InChIKey: IUWPMHYAMOUYKQ-UHFFFAOYSA-N