5-(4-METHYLPHENYL)-1,3,4-OXADIAZOLE-2-THIOL

Catalog No: FT-0620747

CAS No: 3004-42-0

Molecular Formula: 178.21
Formula Weight: C8H6N2OS
Inchl Key: FOHWXVBZGSVUGO-UHFFFAOYSA-N
Inchl: InChI=1S/C8H6N2OS/c12-8-10-9-7(11-8)6-4-2-1-3-5-6/h1-5H,(H,10,12)

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

Bolling_Point:	306.9±25.0 °C at 760 mmHg
CAS:	3004-42-0
MF:	C8H6N2OS
Melting_Point:	219-222 °C(lit.)
Symbol:	Warning
Density:	1.3±0.1 g/cm3
FW:	178.211
Product_Name:	5-Phenyl-1,3,4-oxadiazole-2(3H)-thione
Flash_Point:	139.4±23.2 °C

Bolling_Point:	306.9±25.0 °C at 760 mmHg
LogP:	2.87
More_Info:	['1 . Appearance 无可用 ', '2 . Density（g/mL,25/4℃）无可用 ', '3 . Relative vapor density（g/mL,Atmosphere =1）无可用 ', '4 . Melting point（ºC）219-222 ', '5 . Boiling point（ºC,Atmospheric pressure）无可用 ', '6 . Boiling point（ºC,52kPa）无可用 ', '7 . Refractive index无可用 ', '8 . Flash point（ºC）无可用 ', '9 . Specific rotation（º）无可用 ', '10 . Spontaneous ignition point or ignition temperature（ºC）无可用 ', '11 . Vapor pressure（kPa,25ºC）无可用 ', '12 . Saturated vapor pressure（kPa,60ºC）无可用 ', '13 . Combustion heat（KJ/mol）无可用 ', '14 . Critical temperature（ºC）无可用 ', '15 . Critical pressure（KPa）无可用 ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient 无可用 ', '17 . Upper limit of explosion（%,V/V）无可用 ', '18 . Lower limit of explosion（%,V/V）无可用 ', '19 . Solubility 无可用']
Computational_Chemistry:	['1. XlogP :2 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :2 ', '6. TPSA 657 ', '7. Heavy Atom Count :12 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :221 ', '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']
Melting_Point:	219-222 °C(lit.)
Vapor_Pressure:	0.0±0.6 mmHg at 25°C
Exact_Mass:	178.020081
MF:	C8H6N2OS
Density:	1.3±0.1 g/cm3
Refractive_Index:	1.612
PSA:	73.91000
Flash_Point:	139.4±23.2 °C
Molecular_Structure:	['1 . Molar refractive index 4913 ', '2 . Molar volume （m3/mol）1288 ', '3 . Parachor （902K）3411 ', '4 . Surface tension 491 ', '5 . Polarizability 1947']
FW:	178.211

Safety_Statements:	H315-H319-H335
HS_Code:	2934999090
WGK_Germany:	3
Hazard_Codes:	Xi: Irritant;
RTECS:	RO0829900
RIDADR:	NONH for all modes of transport
Risk_Statements(EU):	R36/37/38
Symbol:	Warning
Personal_Protective_Equipment:	dust mask type N95 (US);Eyeshields;Gloves
Warning_Statement:	P261-P305 + P351 + P338