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Cas Database |
| Name |
6-Bromo-2,3-dihydrobenzofuran-3-amine |
EINECS | N/A |
| CAS No. | 944709-63-1 | Density | 1.605 |
| PSA | 35.25000 | LogP | 3.34360 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C8H8BrNO.HCl | Boiling Point | 298.8 °C at 760 mmHg |
| Molecular Weight | 214.062 | Flash Point | 134.5 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
6-bromo-2,3-dihydrobenzofuran-3-amine hydrochloride;6-Bromo-2,3-dihydrobenzofuran-3-amine HCl; |
Article Data | 4 |
6-Bromo-2,3-dihydrobenzofuran-3-amine Specification
The 6-Bromo-2,3-dihydrobenzofuran-3-amine, with the CAS registry number 944709-63-1, has the systematic name of 6-bromo-2,3-dihydrobenzofuran-3-amine hydrochloride. The molecular formula of the chemical is C8H8BrNO.HCl.
The characteristics of this chemical are as followings: (1)ACD/LogP: 1.61; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 7.4): 0.93 ; (4)#H bond acceptors: 2; (5)#H bond donors: 2; (6)#Freely Rotating Bonds: 1; (7)Polar Surface Area: 35.25 Å2; (8)Flash Point: 134.5 °C; (9)Enthalpy of Vaporization: 54.95 kJ/mol; (10)Boiling Point: 298.8 °C at 760 mmHg; (11)Vapour Pressure: 0.00093 mmHg at 25°C.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Cl.Brc1ccc2c(c1)OCC2N
(2)InChI: InChI=1/C8H8BrNO.ClH/c9-5-1-2-6-7(10)4-11-8(6)3-5;/h1-3,7H,4,10H2;1H
(3)InChIKey: BTTOLFCXRXFGKD-UHFFFAOYAH
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