Molecular Formula: 452.6
Formula Weight: C27H28N6O
Inchl Key: PRDFBSVERLRRMY-UHFFFAOYSA-N
Inchl: InChI=1S/C27H28N6O/c1-3-34-21-8-4-18(5-9-21)26-28-22-10-6-19(16-24(22)30-26)27-29-23-11-7-20(17-25(23)31-27)33-14-12-32(2)13-15-33/h4-11,16-17H,3,12-15H2,1-2H3,(H,28,30)(H,29,31)

Assay	Pack	Price	Stock
98%	1g	N/A	N/A
98%	5g	N/A	N/A
98%	Bulk Quantity	N/A	N/A

Symbol:	Warning
FW:	561.934
Density:	N/A
CAS:	23491-52-3
Bolling_Point:	N/A
Product_Name:	Hoechst 33342
Melting_Point:	268ºC
Flash_Point:	N/A
MF:	C27H37Cl3N6O4

Computational_Chemistry:	['1. XlogP :46 ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :5 ', '4. Rotatable Bond Count :5 ', '5. Isotope Atom Count :7 ', '6. TPSA 731 ', '7. Heavy Atom Count :34 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :664 ', '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:	7.13970
FW:	561.934
Melting_Point:	268ºC
More_Info:	['1 . Appearance Yellow 粉末 ', '2 . Density（g/mL,25/4℃）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）92-95 ', '5 . Boiling point（ºC,60mmhg）Unknow ', '6 . Boiling point（ºC,52kPa）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（kPa,25ºC）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（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']
PSA:	100.76000
MF:	C27H37Cl3N6O4
Exact_Mass:	560.162476

Hazard_Codes:	Xn: Harmful;
Symbol:	Warning
Warning_Statement:	P280-P301 + P312 + P330
HS_Code:	2933990090
Personal_Protective_Equipment:	dust mask type N95 (US);Eyeshields;Gloves
RTECS:	SM1140500
Risk_Statements(EU):	R22
Safety_Statements:	S22-S36/37-S24/25
RIDADR:	NONH for all modes of transport
WGK_Germany:	3