1H-Pyrazole-4-carboxylic acid, 3,5-dimethyl-, ethyl ester
-
1H-Pyrazole-4-carboxylic acid, 3,5-dimethyl-, ethyl ester
structure -
-
CAS No:
35691-93-1
-
Formula:
C8H12N2O2
-
Chemical Name:
1H-Pyrazole-4-carboxylic acid, 3,5-dimethyl-, ethyl ester
-
Synonyms:
1H-Pyrazole-4-carboxylic acid,3,5-dimethyl-,ethyl ester;Ethyl 3,5-dimethylpyrazole-4-carboxylate;3,5-Dimethylpyrazole-4-carboxylic acid ethyl ester;Ethyl 3,5-dimethyl-1H-pyrazole-4-carboxylate;3,5-Dimethyl-1H-pyrazole-4-carboxylic acid ethyl ester
-
CAS No:
1H-Pyrazole-4-carboxylic acid, 3,5-dimethyl-, ethyl ester Basic Attributes
168.19
168.19
SS3UNU86DP
DTXSID80189206
2933199090
Characteristics
55
1.2
1.136g/cm3
96 °C
284.8°C at 760 mmHg
126ºC
1.518
LDLo oral in mouse: 250mg/kg
Safety Information
IRRITANT
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
1H-Pyrazole-4-carboxylic acid, 3,5-dimethyl-, ethyl ester Use and Manufacturing
To a solution of reagent 1 (4.6 mg, 26.7 mmol) in EtOH (50 mL) was added hydrazine hydrochloride (1.8 g, 26.7 mmol). The mixture was heated to reflux for 2 hours. The solvent was removed under reduced pressure and the residue was washed with EtOAc to give reagent 2 as a colorless solid (3.1 g, 69percent) sufficiently pure for the next step.To a solution of reagent 1 (4.6 mg, 26.7 mmol) in EtOH (50 mL) was added hydrazine hydrochloride (1.8 g, 26.7 mmol). The mixture was heated to reflux for 2 hours. The solvent was removed under reduced pressure and the residue was washed with EtOAc to give reagent 2 as a colorless solid (3.1 g, 69%) sufficiently pure for the next step.
Computed Properties
Molecular Weight:168.19
XLogP3:1.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:168.089877630
Monoisotopic Mass:168.089877630
Topological Polar Surface Area:55
Heavy Atom Count:12
Complexity:172
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Learn More Other Chemicals
-
Cyclohexanecarboxylic acid, 1,3,4,5-tetrahydroxy-, ethyl ester, (1alpha,3R,4alpha,5R)- (9CI)
463325-95-3
-
Cyclopropanecarboxylic acid, 1-formyl-2-methyl-, ethyl ester (9CI)
260261-27-6
-
Cyclopentanecarboxylic acid, 2-(hydroxyimino)-, methyl ester (9CI)
170016-09-8
-
3-CYCLOPROPYL-2-METHYL-3-OXO-PROPIONIC ACID ETHYL ESTER Formula
21741-37-7
-
Cyclopropanecarboxylic acid, 1-amino-2-phenyl-, ethyl ester, (1R,2R)-rel- (9CI) Formula
669058-57-5
-
Cyclopropanecarboxylic acid, 1-amino-2-ethenyl-, ethyl ester, (1R,2S)-rel- (9CI) Formula
213316-32-6
-
Cyclopropanecarboxylic acid, 1-amino-2-ethenyl-, ethyl ester, hydrochloride (9CI) Structure
681807-60-3
-
3-Cyclopentene-1-carboxylic acid, 1-(chlorocarbonyl)-, ethyl ester (9CI) Structure
76910-09-3
-
What is Cyclopropanecarboxylic acid, 2-propyl-, ethyl ester, (1R,2S)- (9CI)
492468-18-5
-
What is 1,2-Benzenedicarboxylic acid, decyl isoundecyl ester
96507-80-1
1H-Pyrazole-4-carboxylic acid, 3,5-dimethyl-, ethyl ester
SDSRequest for Quotation