Chemical Name: Nequinate
Molecular Formula: C22H23NO4
Molecular Weight: 365.4
InChI Key: NNOPDLNHPOLRRE-UHFFFAOYSA-N
InChI: InChI=1S/C22H23NO4/c1-3-4-10-16-11-17-19(23-13-18(21(17)24)22(25)26-2)12-20(16)27-14-15-8-6-5-7-9-15/h5-9,11-13H,3-4,10,14H2,1-2H3,(H,23,24)

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

Symbol:	Warning
FW:	365.422
Density:	1.2±0.1 g/cm3
CAS:	13997-19-8
Bolling_Point:	520.7±50.0 °C at 760 mmHg
Product_Name:	nequinate
Melting_Point:	287.5ºC
Flash_Point:	268.7±30.1 °C
MF:	C22H23NO4

Flash_Point:	268.7±30.1 °C
Refractive_Index:	1.579
FW:	365.422
Density:	1.2±0.1 g/cm3
Bolling_Point:	520.7±50.0 °C at 760 mmHg
Computational_Chemistry:	['1. XlogP :5 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :5 ', '4. Rotatable Bond Count :8 ', '5. Isotope Atom Count :4 ', '6. TPSA 646 ', '7. Heavy Atom Count :27 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :553 ', '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']
LogP:	6.01
Melting_Point:	287.5ºC
PSA:	68.39000
MF:	C22H23NO4
More_Info:	['1 . Appearance 浅Yellow 无味粉末 ', '2 . Density（g/mL,25℃）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，2mmHg）Unknow ', '7 . Refractive index(n20/D)Unknow ', '8 . Flash point（ºC）Unknow ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（mmHg,20ºC）Unknow ', '12 . Saturated vapor pressure（kPa,25ºC）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 4203 ', '17 . Upper limit of explosion（%,V/V）Unknow ', '18 . Lower limit of explosion（%,V/V）Unknow ', '19 . Solubility Insoluble in Water ']
Vapor_Pressure:	0.0±1.4 mmHg at 25°C
Exact_Mass:	365.162720

Personal_Protective_Equipment:	dust mask type N95 (US);Eyeshields;Gloves
Hazard_Codes:	Xn: Harmful;
Risk_Statements(EU):	R22
Safety_Statements:	H302-H413
Symbol:	Warning
RIDADR:	NONH for all modes of transport
HS_Code:	2933499090