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Benzoquinoxaline

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Name

Benzoquinoxaline

EINECS N/A
CAS No. 230-33-1 Density 1.25 g/cm3
PSA 25.78000 LogP 2.78300
Solubility N/A Melting Point N/A
Formula C12H8N2 Boiling Point 354.9 °C at 760 mmHg
Molecular Weight 180.21 Flash Point 158.9 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 230-33-1 (Benzoquinoxaline) Hazard Symbols N/A
Synonyms

1,4-Diazaphenanthrene;1,4-Phenanthroline;5,6-Benzoquinoxaline;NSC 48954;Benzo[f]quinoxaline;

Article Data 9

Benzoquinoxaline Specification

The CAS register number of Benzo[f]quinoxaline is 230-33-1. It also can be called as 5,6-Benzoquinoxaline and the IUPAC name about this chemical is benzo[f]quinoxaline. The molecular formula about this chemical is C12H8N2 and the molecular weight is 180.20532 [g/mol].

Physical properties about Benzo[f]quinoxaline are: (1)ACD/LogP: 2.53; (2)ACD/LogD (pH 5.5): 2.53; (3)ACD/LogD (pH 7.4): 2.53; (4)ACD/BCF (pH 5.5): 49.1; (5)ACD/BCF (pH 7.4): 49.1; (6)ACD/KOC (pH 5.5): 565.06; (7)ACD/KOC (pH 7.4): 565.07; (8)#H bond acceptors: 2; (9)Polar Surface Area: 25.78Å2; (10)Index of Refraction: 1.74; (11)Molar Refractivity: 58.12 cm3; (12)Molar Volume: 144.1 cm3; (13)Polarizability: 23.04x10-24cm3; (14)Surface Tension: 61.2 dyne/cm; (15)Enthalpy of Vaporization: 57.63 kJ/mol; (16)Boiling Point: 354.9 °C at 760 mmHg; (17)Vapour Pressure: 6.64E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: n1c2c(ncc1)ccc3c2cccc3
(2)InChI: InChI=1/C12H8N2/c1-2-4-10-9(3-1)5-6-11-12(10)14-8-7-13-11/h1-8H
(3)InChIKey: YUFRAQHYKKPYLH-UHFFFAOYAV
(4)Std. InChI: InChI=1S/C12H8N2/c1-2-4-10-9(3-1)5-6-11-12(10)14-8-7-13-11/h1-8H
(5)Std. InChIKey: YUFRAQHYKKPYLH-UHFFFAOYSA-N

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