5-AMINO-3-METHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID ETHYL ESTER
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5-AMINO-3-METHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID ETHYL ESTER
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CAS No:
23286-70-6
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Formula:
C7H11N3O2
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Chemical Name:
5-AMINO-3-METHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID ETHYL ESTER
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Synonyms:
ETHYL 5-AMINO-3-METHYL-1H-PYRAZOLE-4-CARBOXYLATE;5-AMINO-3-METHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID ETHYL ESTER;1H-Pyrazole-4-carboxylic acid, 3-amino-5-methyl-, ethyl ester;5-Amino-3-methyl-1H-pyrazole-4-carboxylic acid;ethyl 1-methyl-5-amino pyrozole carboxylate;Ethyl 3-amino-5-methyl-1H-pyrazole-4-carboxylate;Pyrazole-4-carboxylic acid, 3-amino-5-methyl-, ethyl ester
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CAS No:
5-AMINO-3-METHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID ETHYL ESTER Basic Attributes
169.18
169.08500
DTXSID20350579
2933199090
Safety Information
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501
H315
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 6 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
5-AMINO-3-METHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID ETHYL ESTER Use and Manufacturing
The preparation method is to put ethyl cyanoacetate, triethyl orthoformate, catalyst and acetic acid into the reaction kettle, heat, start refluxing to vaporize the produced ethanol, then continue to heat up to 130~155℃, react for 6 h, after the reaction is over , Distill off triethyl orthoformate under reduced pressure, send the residue to the pyrazolamide reactor, add ethanol, continue to cool to about 0°C, add methylhydrazine ethanol solution, heat up and reflux for 1 h, evaporate ethanol, add toluene, and cool , Crystallization, filtration and drying to obtain the finished product.
1-Methyl-5-aminopyrazole-4-carboxylic acid ethyl ester, also known as 1-methyl-4-ethoxycarbonyl-5-pyrazolamide, is an intermediate of the herbicide pyrasulfuron.
Computed Properties
Molecular Weight:169.18
XLogP3:1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:169.085126602
Monoisotopic Mass:169.085126602
Topological Polar Surface Area:81
Heavy Atom Count:12
Complexity:174
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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