4-Bromo-6-cyanoindole supplier

Name
4-BROMO-6-CYANOINDOLE
EINECS 200-258-5
CAS No. 374633-29-1
Density 1.74 g/cm³
Solubility
Melting Point
Formula C₉H₅BrN₂
Boiling Point 379.8 °C at 760 mmHg
Molecular Weight 221.056
Flash Point 183.5 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-Bromo-1H-indole-6-carbonitrile;4-bromo-1H-indole-6-carbonitrile;1H-indole-6-carbonitrile, 4-bromo-;4-Bromo-1H-indole-6-carbonitrile;4-Bromo-6-cyanoindole;
PSA 39.58000
LogP 2.80208

4-Bromo-6-cyanoindole Specification

The 4-Bromo-6-cyanoindole, with the CAS registry number 374633-29-1, has the systematic name of 4-bromo-1H-indole-6-carbonitrile. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C₉H₅BrN₂.

The characteristics of 4-Bromo-6-cyanoindole are as followings: (1)ACD/LogP: 2.86; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.86; (4)ACD/LogD (pH 7.4): 2.86; (5)#H bond acceptors: 2; (6)#H bond donors: 1; (7)#Freely Rotating Bonds: 0; (8)Polar Surface Area: 39.58 Å²; (9)Index of Refraction: 1.726; (10)Molar Refractivity: 50.52 cm³; (11)Molar Volume: 127 cm³; (12)Polarizability: 20.02×10^-24cm³; (13)Surface Tension: 72.2 dyne/cm; (14)Density: 1.74 g/cm³; (15)Flash Point: 183.5 °C; (16)Enthalpy of Vaporization: 62.79 kJ/mol; (17)Boiling Point: 379.8 °C at 760 mmHg; (18)Vapour Pressure: 5.7E-06 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: N#Cc2cc1nccc1c(Br)c2
(2)InChI: InChI=1/C9H5BrN2/c10-8-3-6(5-11)4-9-7(8)1-2-12-9/h1-4,12H
(3)InChIKey: LIXMZLHXLYDHRO-UHFFFAOYAB

Product Name

4-BROMO-6-CYANOINDOLE

4-Bromo-6-cyanoindole Specification

Related Products

Hot Products