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51363-00-9

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Basic Information
CAS No.: 51363-00-9
Name: 4-(Pyrid-2-yloxy)benzoic acid
Article Data: 6
Molecular Structure:
Molecular Structure of 51363-00-9 (4-(Pyrid-2-yloxy)benzoic acid)
Formula: C12H9NO3
Molecular Weight: 215.208
Synonyms: 4-(2-pyridinyloxy)benzoic acid;4-(2-pyridinyloxy)benzoic acid (IM OCS);
Density: 1.298 g/cm3
Melting Point: 174 °C
Boiling Point: 391.208 °C at 760 mmHg
Flash Point: 190.396 °C
PSA: 59.42000
LogP: 2.57210
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Specification

The CAS register number of 4-(Pyrid-2-yloxy)benzoic acid is 51363-00-9. It also can be called as 4-(2-pyridinyloxy)benzoic acid. The molecular formula about this chemical is C12H9NO3 and the molecular weight is 215.2.

Physical properties about 4-(Pyrid-2-yloxy)benzoic acid are: (1)ACD/LogP: 2.14; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 7; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 4; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 3; (9)Polar Surface Area: 59.42 Å2; (10)Index of Refraction: 1.613; (11)Molar Refractivity: 57.718 cm3; (12)Molar Volume: 165.774 cm3; (13)Polarizability: 22.881x10-24cm3; (14)Surface Tension: 56.59 dyne/cm; (15)Density: 1.298 g/cm3; (16)Flash Point: 190.396 °C; (17)Enthalpy of Vaporization: 67.583 kJ/mol; (18)Boiling Point: 391.208 °C at 760 mmHg. 

You can still convert the following datas into molecular structure:
(1)SMILES: OC(=O)c1ccc(cc1)Oc2ccccn2
(2)InChI: InChI=1/C12H9NO3/c14-12(15)9-4-6-10(7-5-9)16-11-3-1-2-8-13-11/h1-8H,(H,14,15)
(3)InChIKey: GKSKQZLHPWBLJL-UHFFFAOYAZ
(4)Std. InChI: InChI=1S/C12H9NO3/c14-12(15)9-4-6-10(7-5-9)16-11-3-1-2-8-13-11/h1-8H,(H,14,15)
(5)Std. InChIKey: GKSKQZLHPWBLJL-UHFFFAOYSA-N