3-PYRID-2-YLBENZOIC ACID

Catalog No: FT-0648282

CAS No: 4467-07-6

Chemical Name: 3-PYRID-2-YLBENZOIC ACID
Molecular Formula: C12H9NO2
Molecular Weight: 199.2
InChI Key: IRXFQXMHMRTLIR-UHFFFAOYSA-N
InChI: InChI=1S/C12H9NO2/c14-12(15)10-5-3-4-9(8-10)11-6-1-2-7-13-11/h1-8H,(H,14,15)

Product pricing and availability information
Assay	Pack Size	Price	Stock
98%	1g	N/A	N/A
98%	5g	N/A	N/A
98%	Bulk Quantity	N/A	N/A

Bolling_Point:	409.0±28.0 °C at 760 mmHg
MF:	C12H9NO2
Density:	1.2±0.1 g/cm3
FW:	199.205
Product_Name:	3-(Pyridin-2-yl)benzoic acid
CAS:	4467-07-6
Flash_Point:	201.1±24.0 °C
Melting_Point:	207ºC

Bolling_Point:	409.0±28.0 °C at 760 mmHg
Vapor_Pressure:	0.0±1.0 mmHg at 25°C
LogP:	2.49
More_Info:	['1 . Appearance 不确定 ', '2 . Density（g/mL ,25/4℃）不确定 ', '3 . Relative vapor density（g/mL,Atmosphere =1）不确定 ', '4 . Melting point（ºC）207 ', '5 . Boiling point（ºC,Atmospheric pressure）不确定 ', '6 . Boiling point（ºC,20mmHg）不确定 ', '7 . Refractive index不确定 ', '8 . Flash point（ºF）不确定 ', '9 . Specific rotation（º）不确定 ', '10 . Spontaneous ignition point or ignition temperature（ºC）不确定 ', '11 . Vapor pressure（kPa,25ºC）不确定 ', '12 . Saturated vapor pressure（kPa,60ºC）不确定 ', '13 . Combustion heat（KJ/mol）不确定 ', '14 . Critical temperature（ºC）不确定 ', '15 . Critical pressure（KPa）不确定 ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient 不确定 ', '17 . Upper limit of explosion（%,V/V）不确定 ', '18 . Lower limit of explosion（%,V/V）不确定 ', '19 . Solubility 不确定']
Computational_Chemistry:	['1 . XlogP 28 ', '2 . Hydrogen Bond Donor Count 0 ', '3 . Hydrogen Bond Acceptor Count 3 ', '4 . Rotatable Bond Count 1 ', '5 . TPSA 53 ', '6 . Heavy Atom Count 15 ', '7 . Topological Polar Surface Area -1 ', '8 . Complexity 224 ', '9 . Isotope Atom Count 0 ', '10 . Defined Atom Stereocenter Count 0 ', '11 . Undefined Atom Stereocenter Count 0 ', '12 . Defined Bond Stereocenter Count 0 ', '13 . Undefined Bond Stereocenter Count 0 ', '14 . Covalently-Bonded Unit Count 1']
Melting_Point:	207ºC
Exact_Mass:	199.063324
MF:	C12H9NO2
Density:	1.2±0.1 g/cm3
Refractive_Index:	1.613
PSA:	50.19000
Flash_Point:	201.1±24.0 °C
Molecular_Structure:	['1 . Molar refractive index 5586 ', '2 . Molar volume （m3/mol）1604 ', '3 . Parachor （902K）4369 ', '4 . Surface tension 549 ', '5 . Polarizability （10 -24cm 3）2214']
FW:	199.205