CAS No.15936-09-1,1,8-NAPHTHYRIDIN-2(8H)-ONE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	15936-09-1
Name:	1,8-NAPHTHYRIDIN-2(8H)-ONE
Article Data:	16

Formula:	C₈H₆N₂O
Molecular Weight:	146.148
Synonyms:	1,8-Naphthyridin-2-ol(8CI);1,8-Naphthyridine-2-one;2-Hydroxy-1,8-naphthyridine;NSC 172919;
Density:	1.267g/cm³
Melting Point:	197-199 °C(Solv: benzene (71-43-2))
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 1,8-Naphthyridin-2(1H)-one, with CAS registry number 15936-09-1, has the systematic name of 1,8-naphthyridin-2(1H)-one. Besides this, it is also called 2-Hydroxy-1,8-naphthyridine. And the chemical formula of this chemical is C₈H₆N₂O.

Physical properties of 1,8-Naphthyridin-2(1H)-one: (1)ACD/LogP: 0.02; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.02; (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): 24.31; (8)ACD/KOC (pH 7.4): 24.35; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 33.2 Å²; (13)Index of Refraction: 1.602; (14)Molar Refractivity: 39.6 cm³; (15)Molar Volume: 115.3 cm³; (16)Polarizability: 15.69×10^-24cm³; (17)Surface Tension: 51.6 dyne/cm; (18)Density: 1.267 g/cm³; (19)Flash Point: 190.8 °C; (20)Enthalpy of Vaporization: 64.15 kJ/mol; (21)Boiling Point: 391.8 °C at 760 mmHg; (22)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\c1c(nccc1)N2
(2)InChI: InChI=1/C8H6N2O/c11-7-4-3-6-2-1-5-9-8(6)10-7/h1-5H,(H,9,10,11)
(3)InChIKey: ZFRUGZMCGCYBRC-UHFFFAOYAT
(4)Std. InChI: InChI=1S/C8H6N2O/c11-7-4-3-6-2-1-5-9-8(6)10-7/h1-5H,(H,9,10,11)
(5)Std. InChIKey: ZFRUGZMCGCYBRC-UHFFFAOYSA-N