6-Acetyl-1,3-benzothiazol-2(3H)-one

Catalog No: FT-0688537

CAS No: 133044-44-7

Chemical Name: 6-Acetyl-1,3-benzothiazol-2(3H)-one
Molecular Formula: C9H7NO2S
Molecular Weight: 193.22
InChI Key: UFRAIEFXNRTICG-UHFFFAOYSA-N
InChI: InChI=1S/C9H7NO2S/c1-5(11)6-2-3-7-8(4-6)13-9(12)10-7/h2-4H,1H3,(H,10,12)

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:	193.222
Density:	1.4±0.1 g/cm3
CAS:	133044-44-7
Bolling_Point:	N/A
Product_Name:	6-Acetyl-1,3-benzothiazol-2(3H)-one
Melting_Point:	190-194ºC
Flash_Point:	N/A
MF:	C9H7NO2S

Molecular_Structure:	['1. Molar refractive index 5087 ', '2. Molar volume 142 ', '3. Parachor （902K）3817 ', '4. Surface tension 521 ', '5. Dielectric constant N/A ', '6. Polarizability 2016 ', '7. Single isotope mass 193019748 Da ', '8. Nominal mass 193 Da ', '9. Average mass 1932224 Da']
Refractive_Index:	1.635
FW:	193.222
Density:	1.4±0.1 g/cm3
Computational_Chemistry:	['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :9 ', '6. TPSA 715 ', '7. Heavy Atom Count :13 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :254 ', '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:	190-194ºC
PSA:	78.17000
MF:	C9H7NO2S
More_Info:	['1 . Appearance Solid ', '2 . Density（g/mL,20℃）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）190-194 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC,KPa）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（Pa,20ºC）Unknow ', '12 . Saturated vapor pressure（KPa,20ºC）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']
Exact_Mass:	193.019745

Personal_Protective_Equipment:	dust mask type N95 (US);Eyeshields;Gloves
Warning_Statement:	P261-P305 + P351 + P338
Safety_Statements:	H315-H319-H335
Symbol:	Warning
RIDADR:	NONH for all modes of transport
HS_Code:	2934200090