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5,7-dichloro-4-oxo-1H-quinoline-2-carboxylic acid

Catalog No: FT-0739743

CAS No: 131123-76-7

Chemical Name: 5,7-dichloro-4-oxo-1H-quinoline-2-carboxylic acid
Molecular Formula: C10H5Cl2NO3
Molecular Weight: 258.05
InChI Key: BGKFPRIGXAVYNX-UHFFFAOYSA-N
InChI: InChI=1S/C10H5Cl2NO3/c11-4-1-5(12)9-6(2-4)13-7(10(15)16)3-8(9)14/h1-3H,(H,13,14)(H,15,16)

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

Melting_Point:	N/A
FW:	258.05800
CAS:	131123-76-7
MF:	C10H5Cl2NO3
Flash_Point:	N/A
Product_Name:	5,7-dichlorokynurenic acid sodium salt
Bolling_Point:	N/A
Density:	N/A

MF:	C10H5Cl2NO3
Exact_Mass:	256.96500
LogP:	2.94540
Molecular_Structure:	['1. Molar refractive index 6078 ', '2. Molar volume 1516 ', '3. Parachor （902K）4541 ', '4. Surface tension 804 ', '5. Dielectric constant N/A ', '6. Polarizability 2409 ', '7. Single isotope mass 256964648 Da ', '8. Nominal mass 257 Da ', '9. Average mass 2580576 Da']
FW:	258.05800
More_Info:	['1 . Appearance 亮Yellow Solid ', '2 . Density（g/mL,20℃）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）Unknow ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC,KPa）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（ºC）Unknow ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（Pa,20ºC）Unknow ', '12 . Saturated vapor pressure（KPa,20ºC）Unknow ', '13 . Combustion heat（KJ/mol）Unknow ', '14 . Critical temperature（ºC）Unknow ', '15 . Critical pressure（KPa）Unknow ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient Unknow ', '17 . Upper limit of explosion（%,V/V）Unknow ', '18 . Lower limit of explosion（%,V/V）Unknow ', '19 . Solubility 可Soluble in NaOH']
PSA:	70.42000
Computational_Chemistry:	['1 . XlogP 25 ', '2 . Hydrogen Bond Donor Count 2 ', '3 . Hydrogen Bond Acceptor Count 4 ', '4 . Rotatable Bond Count 1 ', '5 . Isotope Atom Count 3 ', '6 . TPSA 664 ', '7 . Heavy Atom Count 16 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 369 ', '10. Isotope Atom Count 0 ', '11. Defined Atom Stereocenter Count 0 ', '12. Undefined Atom Stereocenter Count 0 ', '13. Defined Bond Stereocenter Count 0 ', '14. Undefined Bond Stereocenter Count 0 ', '15. Covalently-Bonded Unit Count 1']

Safety_Statements:	S26-S36
Hazard_Codes:	Xi
HS_Code:	2933499090
Risk_Statements(EU):	R36/37/38:Irritating to eyes, respiratory system and skin .
WGK_Germany:	3