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Benzeneethanamine,4-bromo-, hydrobromide (1:1)

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Name

Benzeneethanamine,4-bromo-, hydrobromide (1:1)

EINECS N/A
CAS No. 206559-45-7 Density N/A
PSA 26.02000 LogP 3.60870
Solubility N/A Melting Point 272 °C
Formula C8H11Br2N Boiling Point 271.3 °C at 760 mmHg
Molecular Weight 280.99 Flash Point 113.1 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 206559-45-7 (4-BROMOPHENETHYLAMINE HYDROBROMIDE) Hazard Symbols IrritantXi,CorrosiveC
Synonyms

Benzeneethanamine,4-bromo-, hydrobromide (9CI);2-(4-Bromophenyl)ethylamine hydrobromide;4-Bromophenylethylamine hydrobromide;

 

Benzeneethanamine,4-bromo-, hydrobromide (1:1) Specification

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

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