1H-Indole-2-carboxaldehyde,6-bromo- supplier

Name
6-BROMO-1H-INDOLE-2-CARBALDEHYDE
EINECS
CAS No. 105191-12-6
Article Data8
CAS DataBase
Density 1.727 g/cm³
Solubility
Melting Point 181-183 °C
Formula C₉H₆BrNO
Boiling Point 395.55 °C at 760 mmHg
Molecular Weight 224.057
Flash Point 193.022 °C
Transport Information
Appearance
Safety 26-36/37
Risk Codes 36-36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms 6-BROMO-1H-INDOLE-2-CARBALDEHYDE;6-Bromo-1H-indole-2-carbaldehyde ,97%;6-BroMo-1H-indol-2-carbaldehyde;6-Bromo-2-formyl-1H-indole
PSA 32.86000
LogP 2.74290

1H-Indole-2-carboxaldehyde,6-bromo- Specification

The 1H-Indole-2-carboxaldehyde,6-bromo-, with the CAS registry number 105191-12-6, is also known as ZINC12984556. This chemical's molecular formula is C₉H₆BrNO and molecular weight is 224.05404. Its IUPAC name is called 6-bromo-1H-indole-2-carbaldehyde.

Physical properties of 1H-Indole-2-carboxaldehyde,6-bromo-: (1)ACD/LogP: 3.07; (2)ACD/LogD (pH 5.5): 2; (3)ACD/LogD (pH 7.4): 2; (4)ACD/BCF (pH 5.5): 35; (5)ACD/BCF (pH 7.4): 35; (6)ACD/KOC (pH 5.5): 444; (7)ACD/KOC (pH 7.4): 444; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 1; (11)Index of Refraction: 1.752; (12)Molar Refractivity: 52.972 cm³; (13)Molar Volume: 129.722 cm³; (14)Surface Tension: 63.551 dyne/cm; (15)Density: 1.727 g/cm³; (16)Flash Point: 193.022 °C; (17)Enthalpy of Vaporization: 64.573 kJ/mol; (18)Boiling Point: 395.55 °C at 760 mmHg; (19)Vapour Pressure: 0 mmHg at 25°C.

Preparation of 1H-Indole-2-carboxaldehyde,6-bromo-: this chemical can be prepared by 6-Bromindol-2-methanol. This reaction will need reagent Mangandioxid and solvent diethyl ether. The reaction time is 2 hours. The yield is about 70%.

1H-Indole-2-carboxaldehyde,6-bromo- can be prepared by 6-Bromindol-2-methanol

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC2=C(C=C1Br)NC(=C2)C=O
(2)InChI: InChI=1S/C9H6BrNO/c10-7-2-1-6-3-8(5-12)11-9(6)4-7/h1-5,11H
(3)InChIKey: IGZHNWFLHSANSN-UHFFFAOYSA-N

Product Name

6-BROMO-1H-INDOLE-2-CARBALDEHYDE

1H-Indole-2-carboxaldehyde,6-bromo- Specification

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