Basic information
- Name:
Quinoline,6-methoxy-5-nitro-
- CAS No.:
6623-91-2
- Molecular Structure:
- Formula:
- C10H8N2O3
- Molecular Weight:
- 204.1821
- Synonyms:
- 5-(Hydroxyl[oxido]amino)-6-methoxyquinoline;5-Nitro-6-methoxyquinoline;6-Methoxy-5-nitroquinoline;NSC 55494;
- Density:
- 1.337 g/cm3
- Melting Point:
- 101-103°C
- Boiling Point:
- 371.9 °C at 760 mmHg
- Flash Point:
- 178.7 °C
- Appearance:
- Yellow Crystalline Solid
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Specification
The Quinoline,6-methoxy-5-nitro-, with CAS registry number 6623-91-2, belongs to the following product categories: (1)Aromatics Compounds; (2)Aromatics; (3)Heterocycles. It has the systematic name of 6-methoxy-5-nitroquinoline. This chemical is a kind of yellow crystalline solid. And the chemical formula of this chemical is C10H8N2O3.
Physical properties of Quinoline,6-methoxy-5-nitro-: (1)ACD/LogP: 1.82; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 5; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 67.94 Å2; (7)Index of Refraction: 1.646; (8)Molar Refractivity: 55.41 cm3; (9)Molar Volume: 152.6 cm3; (10)Polarizability: 21.96×10-24cm3; (11)Surface Tension: 55.9 dyne/cm; (12)Density: 1.337 g/cm3; (13)Flash Point: 178.7 °C; (14)Enthalpy of Vaporization: 59.47 kJ/mol; (15)Boiling Point: 371.9 °C at 760 mmHg; (16)Vapour Pressure: 2.14E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: [O-][N+](=O)c1c(OC)ccc2ncccc12
(2)InChI: InChI=1/C10H8N2O3/c1-15-9-5-4-8-7(3-2-6-11-8)10(9)12(13)14/h2-6H,1H3
(3)InChIKey: RYJDGHWDTDEBGQ-UHFFFAOYAD
(4)Std. InChI: InChI=1S/C10H8N2O3/c1-15-9-5-4-8-7(3-2-6-11-8)10(9)12(13)14/h2-6H,1H3
(5)Std. InChIKey: RYJDGHWDTDEBGQ-UHFFFAOYSA-N