5-Methylisoxazole-3-carboxylic acid

Name: 5-Methylisoxazole-3-carboxylic acid
Rating: 4.5 (11 reviews)

Catalog No: FT-0620625

CAS No: 3405-77-4

Molecular Formula: 127.1
Formula Weight: C5H5NO3
Inchl Key: BNMPIJWVMVNSRD-UHFFFAOYSA-N
Inchl: InChI=1S/C5H5NO3/c1-3-2-4(5(7)8)6-9-3/h2H,1H3,(H,7,8)

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

FW:	127.098
CAS:	3405-77-4
Melting_Point:	168 °C
Bolling_Point:	312.5±22.0 °C at 760 mmHg
MF:	C5H5NO3
Product_Name:	5-Methylisoxazole-3-carboxylic acid
Flash_Point:	142.8±22.3 °C
Density:	1.3±0.1 g/cm3

FW:	127.098
MF:	C5H5NO3
Refractive_Index:	1.514
Vapor_Pressure:	0.0±0.7 mmHg at 25°C
Bolling_Point:	312.5±22.0 °C at 760 mmHg
Exact_Mass:	127.026939
PSA:	63.33000
Computational_Chemistry:	['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :N/A ', '6. TPSA 633 ', '7. Heavy Atom Count :9 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :125 ', '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']
Molecular_Structure:	['1 . Molar refractive index 2839 ', '2 . Molar volume （m3/mol）942 ', '3 . Parachor （902K）2551 ', '4 . Surface tension 537 ', '5 . Polarizability （10 -24cm 3）1125']
LogP:	0.68
Melting_Point:	168 °C
Flash_Point:	142.8±22.3 °C
Density:	1.3±0.1 g/cm3
More_Info:	['1 . Appearance White or 奶油色粉末 ', '2 . Density（g/mL,25/4℃）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）171-173 ', '5 . Boiling point（ºC,Atmospheric pressure）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']