CAS No.23616-29-7,1,6-Naphthyridin-2(1H)-one Suppliers

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Basic Information

Molecular Structure:
CAS No.:	23616-29-7
Name:	1,6-Naphthyridin-2(1H)-one
Article Data:	10

Formula:	C₈H₆N₂O
Molecular Weight:	146.148
Synonyms:	1,6-Naphthyridin-2-ol;
Density:	1.267 g/cm³
Melting Point:	303-304℃
Boiling Point:	391.8 °C at 760 mmHg
Flash Point:	190.8 °C
PSA:	45.75000
LogP:	0.92310

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Specification

The 1,6-Naphthyridin-2(1H)-one, with the CAS registry number of 23616-29-7, is also known as 1,6-Naphthyridin-2-ol. This chemical's molecular formula is C₈H₆N₂O and molecular weight is 146.15. What's more, its IUPAC name is 1,6-Naphthyridin-2(1H)-one. In addition, it must be stored in airtight containers and placed in a dry, cool place.

Physical properties about the 1,6-Naphthyridin-2(1H)-one are: (1)ACD/LogP: 0.02; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.09; (4)ACD/LogD (pH 7.4): 0.02; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 18.92; (8)ACD/KOC (pH 7.4): 24.27; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 33.2 Å²; (13)Molar Refractivity: 39.6 cm³; (14)Molar Volume: 115.3 cm³; (15)Surface Tension: 51.6 dyne/cm; (16)Density: 1.267 g/cm³; (17)Flash Point: 190.8 °C; (18)Enthalpy of Vaporization: 64.15 kJ/mol; (19)Boiling Point: 391.8 °C at 760 mmHg; (20)Vapour Pressure: 2.4E-06 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C2/C=C\c1cnccc1N2
(2) InChI: InChI=1/C8H6N2O/c11-8-2-1-6-5-9-4-3-7(6)10-8/h1-5H,(H,10,11)
(3) InChIKey: ZQKMVHXJWJNEQG-UHFFFAOYAY