Molecular Formula: 213.31
Formula Weight: C8H15N5S
Inchl Key: MGLWZSOBALDPEK-UHFFFAOYSA-N
Inchl: InChI=1S/C8H15N5S/c1-4-9-6-11-7(10-5-2)13-8(12-6)14-3/h4-5H2,1-3H3,(H2,9,10,11,12,13)

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:	213.303
Density:	1.3±0.1 g/cm3
CAS:	1014-70-6
Bolling_Point:	302.5±25.0 °C at 760 mmHg
Product_Name:	Simetryn
Melting_Point:	82-83°C
Flash_Point:	136.8±23.2 °C
MF:	C8H15N5S

Molecular_Structure:	['1 . Molar refractive index 5859 ', '2 . Molar volume （m3/mol）1795 ', '3 . Parachor （902K）4959 ', '4 . Surface tension 581 ', '5 . Dielectric constant 不可用 ', '6 偶极距（10 -24cm 3）不可用 ', '7 . Polarizability 2323']
Flash_Point:	136.8±23.2 °C
Refractive_Index:	1.623
FW:	213.303
Density:	1.3±0.1 g/cm3
Bolling_Point:	302.5±25.0 °C at 760 mmHg
Computational_Chemistry:	['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :6 ', '4. Rotatable Bond Count :5 ', '5. Isotope Atom Count :5 ', '6. TPSA 88 ', '7. Heavy Atom Count :14 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :143 ', '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:	1.21
Melting_Point:	82-83°C
PSA:	88.03000
MF:	C8H15N5S
More_Info:	['1 . Appearance White 晶体。 ', '2 . Density（g/mL,25℃）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）82-83 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC,18mmHg）Unknow ', '7 . Refractive index（n 20/D ）Unknow ', '8 . Flash point（ºF）Unknow ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（uPa,20ºC）947uPa ', '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 22℃Water 中溶解度为450ppm，易Soluble in 甲醇 Ethanol 氯仿']
Vapor_Pressure:	0.0±0.6 mmHg at 25°C
Exact_Mass:	213.104813

Personal_Protective_Equipment:	dust mask type N95 (US);Eyeshields;Faceshields;Gloves
RTECS:	XY4025000
Risk_Statements(EU):	R22;R50/53
Safety_Statements:	S2-S60-S61
Symbol:	Warning
Warning_Statement:	P273-P501
RIDADR:	UN 3077 9/PG 3
Hazard_Codes:	Xn:Harmful;N:Dangerousfortheenvironment;
HS_Code:	2933699012