| Identification | |
| Name: | 5(6H)-Isoquinolinone,7,8-dihydro- |
| Synonyms: | 5(6H)-Isoquinolone,7,8-dihydro- (6CI,8CI);7,8-Dihydroisoquinolin-5(6H)-one; |
| CAS: | 21917-86-2 |
| Molecular Formula: | C9H9NO |
| Molecular Weight: | 147.17 |
| InChI: | InChI=1/C9H9NO/c11-9-3-1-2-7-6-10-5-4-8(7)9/h4-6H,1-3H2 |
| Molecular Structure: |  |
| Properties | |
| Density: | 1.168 g/cm3 |
| Refractive index: | 1.569 |
| Specification: |
The 7,8-Dihydro-5(6H)-isoquinolinone, with cas registry number 21917-86-2, belongs to the following product categories: Isoquinoline Derivertives. It has the systematic name of 7,8-dihydroisoquinolin-5(6H)-one. Besides this, it is also called 5(6H)-Isoquinolinone, 7,8-dihydro-. Physical properties about this chemical are: (1)ACD/LogP: 0.40; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 5; (6)ACD/BCF (pH 7.4): 5; (7)ACD/KOC (pH 5.5): 103; (8)ACD/KOC (pH 7.4): 105; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 29.96 Å2; (13)Index of Refraction: 1.569; (14)Molar Refractivity: 41.261 cm3; (15)Molar Volume: 125.984 cm3; (16)Polarizability: 16.357×10-24cm3; (17)Surface Tension: 48.994 dyne/cm; (18)Enthalpy of Vaporization: 52.657 kJ/mol; (19)Vapour Pressure: 0.002 mmHg at 25°C. You can still convert the following datas into molecular structure: |
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