Basic Information | Post buying leads | Suppliers | Cas Database |
The Furo[2, 3-c]pyridin-3(2H)-one, with the CAS registry number 106531-52-6, is also known as TX-010466. It belongs to the product category of Pyridine. This chemical's molecular formula is C7H5NO2 and molecular weight is 135.1201. What's more, its IUPAC name is Furo[2, 3-c]pyridin-3-one.
Physical properties about Furo[2, 3-c]pyridin-3(2H)-one are: (1)ACD/LogP: 0.44; (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): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 45; (8)ACD/KOC (pH 7.4): 45; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 39.19 Å2; (13)Index of Refraction: 1.593; (14)Molar Refractivity: 33.642 cm3; (15)Molar Volume: 99.289 cm3; (16)Polarizability: 13.337×10-24 cm3; (17)Surface Tension: 57.579 dyne/cm; (18)Density: 1.361 g/cm3; (19)Flash Point: 128.964 °C; (20)Enthalpy of Vaporization: 52.895 kJ/mol; (21)Boiling Point: 289.63 °C at 760 mmHg; (22)Vapour Pressure: 0.002 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: O=C2COc1cnccc12
(2) InChI: InChI=1/C7H5NO2/c9-6-4-10-7-3-8-2-1-5(6)7/h1-3H,4H2
(3) InChIKey: KHRZFVYHKRMYLE-UHFFFAOYAL