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Cas Database |
| Name |
1H-Indol-3-ol,5-bromo-4-chloro- |
EINECS | N/A |
| CAS No. | 117887-41-9 | Density | 1.919 g/cm3 |
| PSA | 36.02000 | LogP | 3.28940 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C8H5BrClNO | Boiling Point | 437.863 °C at 760 mmHg |
| Molecular Weight | 246.491 | Flash Point | 218.612 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Indoxyl,5-bromo-4-chloro- (6CI); |
Article Data | 3 |
1H-Indol-3-ol,5-bromo-4-chloro- Specification
The 1H-Indol-3-ol,5-bromo-4-chloro-, with the CAS registry number 117887-41-9, is also known as 5-Brom-4-chlor-1H-indol-3-ol. This chemical's molecular formula is C8H5BrClNO and molecular weight is 246.4884. Its systematic name is called 5-bromo-4-chloro-1H-indol-3-ol.
Physical properties of 1H-Indol-3-ol,5-bromo-4-chloro-: (1)ACD/LogP: 2.86; (2)#H bond acceptors: 2; (3)#H bond donors: 2; (4)#Freely Rotating Bonds: 1; (5)Index of Refraction: 1.763; (6)Molar Refractivity: 52.995 cm3; (7)Molar Volume: 128.437 cm3; (8)Surface Tension: 70.441 dyne/cm; (9)Density: 1.919 g/cm3; (10)Flash Point: 218.612 °C; (11)Enthalpy of Vaporization: 72.135 kJ/mol; (12)Boiling Point: 437.863 °C at 760 mmHg; (13)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Brc1ccc2c(c1Cl)c(O)cn2
(2)InChI: InChI=1/C8H5BrClNO/c9-4-1-2-5-7(8(4)10)6(12)3-11-5/h1-3,11-12H
(3)InChIKey: AXCKOXONHIRKQP-UHFFFAOYAB
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