6-Methylcinnoline supplier | CasNO.318276-69-6

Name
6-Methylcinnoline,
EINECS
CAS No. 318276-69-6
Density 1.141g/cm³
Solubility
Melting Point
Formula C₉H₈N₂
Boiling Point 280.5 °C at 760 mmHg
Molecular Weight 144.17
Flash Point 127.1 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 6-Methylcinnoline,
PSA 25.78000
LogP 1.93820

6-Methylcinnoline Specification

The 6-Methylcinnoline, with CAS registry number 318276-69-6, belongs to the following product category: Cinnoline Derivertives. It has the systematic name of cinnoline, 6-methyl-. And the chemical formula of this chemical is C₉H₈N₂.

Physical properties of 6-Methylcinnoline: (1)ACD/LogP: 1.39; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.39; (4)ACD/LogD (pH 7.4): 1.39; (5)ACD/BCF (pH 5.5): 6.67; (6)ACD/BCF (pH 7.4): 6.71; (7)ACD/KOC (pH 5.5): 135.09; (8)ACD/KOC (pH 7.4): 135.88; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 25.78 Å²; (13)Index of Refraction: 1.633; (14)Molar Refractivity: 45.1 cm³; (15)Molar Volume: 126.2 cm³; (16)Polarizability: 17.88×10^-24cm³; (17)Surface Tension: 50.7 dyne/cm; (18)Enthalpy of Vaporization: 49.83 kJ/mol; (19)Vapour Pressure: 0.00642 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cc1ccc2c(c1)ccnn2
(2)InChI: InChI=1/C9H8N2/c1-7-2-3-9-8(6-7)4-5-10-11-9/h2-6H,1H3
(3)InChIKey: CJNZAPGGKOQHQV-UHFFFAOYAF
(4)Std. InChI: InChI=1S/C9H8N2/c1-7-2-3-9-8(6-7)4-5-10-11-9/h2-6H,1H3
(5)Std. InChIKey: CJNZAPGGKOQHQV-UHFFFAOYSA-N

Product Name

6-Methylcinnoline,

6-Methylcinnoline Specification

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