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4-(1H-Tetrazol-5-yl)benzoic acid

Catalog No: FT-0684325

CAS No: 34114-12-0

Chemical Name: 4-(1H-Tetrazol-5-yl)benzoic acid
Molecular Formula: C8H6N4O2
Molecular Weight: 190.16
InChI Key: GEKBULKUEADYRB-UHFFFAOYSA-N
InChI: InChI=1S/C8H6N4O2/c13-8(14)6-3-1-5(2-4-6)7-9-11-12-10-7/h1-4H,(H,13,14)(H,9,10,11,12)

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

Product_Name:	4-(1H-Tetrazol-5-yl)benzoic Acid
Flash_Point:	236.5ºC
Melting_Point:	248-250ºC
FW:	190.15900
Density:	1.518g/cm3
CAS:	34114-12-0
Bolling_Point:	467.5ºC at 760mmHg
MF:	C8H6N4O2

Density:	1.518g/cm3
Computational_Chemistry:	['1. XlogP :07 ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :5 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :4 ', '6. TPSA 918 ', '7. Heavy Atom Count :14 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :215 ', '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:	0.56490
Flash_Point:	236.5ºC
Melting_Point:	248-250ºC
FW:	190.15900
PSA:	91.76000
MF:	C8H6N4O2
More_Info:	['1 . Appearance Unknow ', '2 . Density（g/mL,20℃）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,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']
Bolling_Point:	467.5ºC at 760mmHg
Exact_Mass:	190.04900