1H-Pyrazole-3-carboxylic acid, 5-hydroxy-1-methyl-, ethyl ester


Chemical Name: 1H-Pyrazole-3-carboxylic acid, 5-hydroxy-1-methyl-, ethyl ester
CAS Number: 51986-17-5
Product Number: AG003QCO(AGN-PC-0OBMFF)
Synonyms:
MDL No: MFCD09839084
Molecular Formula: C7H10N2O3
Molecular Weight: 170.1659

Identification/Properties


Properties
MP:
140-141℃
BP:
337.216°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
170.168g/mol
XLogP3:
0.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
170.069g/mol
Monoisotopic Mass:
170.069g/mol
Topological Polar Surface Area:
58.6A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
247
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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