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COBALT TPP

4-[(3-oxo-1,4-benzoxazin-4-yl)methyl]benzoic acid

Catalog No: FT-0750309

CAS No: 857492-98-9

Chemical Name: 4-[(3-oxo-1,4-benzoxazin-4-yl)methyl]benzoic acid
Molecular Formula: C16H13NO4
Molecular Weight: 283.28 g/mol
InChI Key: YVNJRPNQFNUCKP-UHFFFAOYSA-N
InChI: InChI=1S/C16H13NO4/c18-15-10-21-14-4-2-1-3-13(14)17(15)9-11-5-7-12(8-6-11)16(19)20/h1-8H,9-10H2,(H,19,20)

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:	589ºC at 760 mmHg
CAS:	857492-98-9
MF:	C16H13NO4
Density:	1.377g/cm3
Melting_Point:	N/A
Product_Name:	4-[(3-oxo-1,4-benzoxazin-4-yl)methyl]benzoic acid
Flash_Point:	310ºC
FW:	283.27900

MF:	C16H13NO4
Density:	1.377g/cm3
Computational_Chemistry:	['1. XlogP :21 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :2 ', '6. TPSA 668 ', '7. Heavy Atom Count :21 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :403 ', '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']
More_Info:	['1 . Appearance 粉末 ', '2 . Density（g/mL20 ºC）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）不确定 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC035mmHg）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（º F）Unknow ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（kPa,）Unknow ', '12 . Saturated vapor pressure（kPa,60ºC）Unknow ', '13 . Combustion heat（KJ/mol）Unknow ', '14 . Critical temperature（ºC）Unknow ', '15 . Critical pressure（KPa）Unknow ', '16 . Oil-water（正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 Unknow']
Exact_Mass:	283.08400
Flash_Point:	310ºC
PSA:	66.84000
LogP:	2.37540
Bolling_Point:	589ºC at 760 mmHg
FW:	283.27900
Refractive_Index:	1.652