1-METHYL-3-PROPYLPYRAZOLE-5-CARBOXYLIC ACID

Catalog No: FT-0643314

CAS No: 139755-99-0

Molecular Formula: 167.19
Formula Weight: C8H11N2O2-
Inchl Key: KOABFSONXOOIIH-UHFFFAOYSA-M
Inchl: InChI=1S/C8H12N2O2/c1-3-4-6-5-7(8(11)12)10(2)9-6/h5H,3-4H2,1-2H3,(H,11,12)/p-1

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:	330.3ºC at 760mmHg
MF:	C8H12N2O2
Density:	1.19g/cm3
FW:	168.19300
Product_Name:	1-Methyl-3-propyl-1H-pyrazole-5-carboxylic acid
CAS:	139755-99-0
Flash_Point:	153.5ºC
Melting_Point:	N/A

Vapor_Pressure:	6.74E-05mmHg at 25°C
Bolling_Point:	330.3ºC at 760mmHg
MF:	C8H12N2O2
Flash_Point:	153.5ºC
FW:	168.19300
Exact_Mass:	168.09000
PSA:	55.12000
LogP:	1.07080
Molecular_Structure:	['1 . Molar refractive index 4520 ', '2 . Molar volume 1410 ', '3 . Parachor （902K）3586 ', '4 . Surface tension 417 ', '5 . Polarizability 1792']
Density:	1.19g/cm3
Computational_Chemistry:	['1. XlogP :13 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :N/A ', '6. TPSA 551 ', '7. Heavy Atom Count :12 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :172 ', '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']