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Basic Information
CAS No.: 215523-34-5
Name: 1,8-NAPHTHYRIDINE-2-CARBOXYLICACIDMONOHYDRATE
Molecular Structure:
Molecular Structure of 215523-34-5 (1,8-NAPHTHYRIDINE-2-CARBOXYLICACIDMONOHYDRATE)
Formula: C9H6N2O2
Molecular Weight: 174.159
Synonyms: 1,8-Naphthyridine-2-carboxylicacid(9CI);1,8-Naphthyridine-2-carboxylic acid;2-Carboxy-1,8-naphthyridine
Density: 1.421 g/cm3
Melting Point: 220℃(dec.)
Boiling Point: 366.8 °C at 760 mmHg
Flash Point: 175.6 °C
PSA: 63.08000
LogP: 1.32800
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Specification

The 1,8-Naphthyridine-2-carboxylic acid is an organic compound with the formula C9H6N2O2. The systematic name of this chemical is 1,8-naphthyridine-2-carboxylic acid. With the CAS registry number 215523-34-5, it is also named as [1,8]naphthyridine-2-carboxylic acid. The product's category is Naphthyridine.

Physical properties about 1,8-Naphthyridine-2-carboxylic acid are: (1)ACD/LogP: 0.59; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 4; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 1; (9)Polar Surface Area: 52.08 Å2; (10)Index of Refraction: 1.697; (11)Molar Refractivity: 47.2 cm3; (12)Molar Volume: 122.5 cm3; (13)Polarizability: 18.71×10-24cm3; (14)Surface Tension: 75.7 dyne/cm; (15)Density: 1.421 g/cm3; (16)Flash Point: 175.6 °C; (17)Enthalpy of Vaporization: 64.7 kJ/mol; (18)Boiling Point: 366.8 °C at 760 mmHg; (19)Vapour Pressure: 5.03E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)c2nc1ncccc1cc2
(2)InChI: InChI=1/C9H6N2O2/c12-9(13)7-4-3-6-2-1-5-10-8(6)11-7/h1-5H,(H,12,13)
(3)InChIKey: SNLMOXFUCILIPL-UHFFFAOYAW
(4)Std. InChI: InChI=1S/C9H6N2O2/c12-9(13)7-4-3-6-2-1-5-10-8(6)11-7/h1-5H,(H,12,13)
(5)Std. InChIKey: SNLMOXFUCILIPL-UHFFFAOYSA-N