Quinoxaline, 6-chloro- supplier

Name
6-CHLOROQUINOXALINE
EINECS
CAS No. 5448-43-1
Article Data2
CAS DataBase
Density 1.349 g/cm³
Solubility
Melting Point 295℃
Formula C₈H₅ClN₂
Boiling Point 276.9 °C at 760 mmHg
Molecular Weight 164.594
Flash Point 147.9 °C
Transport Information
Appearance
Safety 26
Risk Codes 22-41
Molecular Structure
Hazard Symbols Xi
Synonyms 6-Chloroquinoxaline;NSC 17797;
PSA 25.78000
LogP 2.28320

Quinoxaline, 6-chloro- Specification

The Quinoxaline, 6-chloro-, with the CAS registry number 5448-43-1, is also known as NSC17797. It belongs to the product category of Quinolines, Quinazolines and derivatives. This chemical's molecular formula is C₈H₅ClN₂ and molecular weight is 164.59. Its IUPAC name is called 6-chloroquinoxaline. When you are using this chemical, please be cautious about it. This chemical may cause inflammation to the skin or other mucous membranes.

Physical properties of Quinoxaline, 6-chloro-: (1)ACD/LogP: 2.10; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.1; (4)ACD/LogD (pH 7.4): 2.1; (5)ACD/BCF (pH 5.5): 23.23; (6)ACD/BCF (pH 7.4): 23.23; (7)ACD/KOC (pH 5.5): 330.67; (8)ACD/KOC (pH 7.4): 330.67; (9)#H bond acceptors: 2; (10)Index of Refraction: 1.662; (11)Molar Refractivity: 45.17 cm³; (12)Molar Volume: 121.9 cm³; (13)Surface Tension: 57.1 dyne/cm; (14)Density: 1.349 g/cm³; (15)Flash Point: 147.9 °C; (16)Enthalpy of Vaporization: 49.47 kJ/mol; (17)Boiling Point: 276.9 °C at 760 mmHg; (18)Vapour Pressure: 0.00788 mmHg at 25°C.

Preparation: this chemical can be prepared by 4-chloro-benzene-1,2-diamine and 1,2-dihydroxy-ethane-1,2-disulfonic acid; disodium salt. This reaction will need reagent sodium acetate, aqueous acetic acid.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC2=NC=CN=C2C=C1Cl
(2)InChI: InChI=1S/C8H5ClN2/c9-6-1-2-7-8(5-6)11-4-3-10-7/h1-5H
(3)InChIKey: HOOMNCITVCXDTR-UHFFFAOYSA-N

Product Name

6-CHLOROQUINOXALINE

Quinoxaline, 6-chloro- Specification

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