Home >> Chemicals Listing >> hot product list by 1  

1H-Pyrazole-3-carboxylicacid, 5-hydroxy-1-methyl-, ethyl ester (51986-17-5)

Identification
Name:1H-Pyrazole-3-carboxylicacid, 5-hydroxy-1-methyl-, ethyl ester
Synonyms:1-Methyl-3-carbethoxy-5-hydroxypyrazole;2-Methyl-3-hydroxy-5-(ethoxycarbonyl)pyrazole;3-Ethoxycarbonyl-5-hydroxy-1-methylpyrazole;5-Hydroxy-1-methyl-1H-pyrazole-3-carboxylic acid ethyl ester;Ethyl5-hydroxy-1-methyl-3-pyrazolecarboxylate;
CAS:51986-17-5
Molecular Formula: C7H10N2O3
Molecular Weight: 170.17
InChI: InChI=1/C7H10N2O3/c1-3-12-7(11)5-4-6(10)9(2)8-5/h4,10H,3H2,1-2H3
Molecular Structure: (C7H10N2O3) 1-Methyl-3-carbethoxy-5-hydroxypyrazole;2-Methyl-3-hydroxy-5-(ethoxycarbonyl)pyrazole;3-Ethoxycarbon...
Properties
Density:1.29g/cm3
Refractive index:1.551
Specification:

The cas register number of Ethyl 5-hydroxy-1-methyl-1H-pyrazole-3-carboxylate is 51986-17-5. It also can be called as 1H-Pyrazole-3-carboxylicacid, 5-hydroxy-1-methyl-, ethyl ester and the IUPAC Name about this chemical is ethyl 2-methyl-3-oxo-1H-pyrazole-5-carboxylate.

Physical properties about Ethyl 5-hydroxy-1-methyl-1H-pyrazole-3-carboxylate are: (1)ACD/LogP: 1.85; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 38; (5)ACD/KOC (pH 7.4): 31; (6)#H bond acceptors: 5; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 4; (9)Polar Surface Area: 64.35Å2; (10)Index of Refraction: 1.551; (11)Molar Refractivity: 41.986 cm3; (12)Molar Volume: 131.503 cm3; (13)Polarizability: 16.644x10-24cm3; (14)Surface Tension: 44.251 dyne/cm; (15)Enthalpy of Vaporization: 60.345 kJ/mol.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCOC(=O)C1=CC(=O)N(N1)C
(2)InChI: InChI=1S/C7H10N2O3/c1-3-12-7(11)5-4-6(10)9(2)8-5/h4,8H,3H2,1-2H3
(3)InChIKey: OMGLOQRFAJAMTB-UHFFFAOYSA-N

Safety Data
 

Other Product