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Home > Encyclopedia > 5-AMINO-3-METHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID ETHYL ESTER

5-AMINO-3-METHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID ETHYL ESTER

5-AMINO-3-METHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID ETHYL ESTER structure

5-AMINO-3-METHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID ETHYL ESTER 

structure
  • CAS No:

    23286-70-6

  • Formula:

    C7H11N3O2

  • Chemical Name:

    5-AMINO-3-METHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID ETHYL ESTER

  • 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

  • Categories:

    Agrochemicals  >  Pesticide Intermediates

5-AMINO-3-METHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID ETHYL ESTER Basic Attributes

169.18

169.08500

DTXSID20350579

2933199090

Characteristics

81

1.05820

1.265g/cm3

54 °C

356.6ºC at 760mmHg

169.5ºC

1.589

0.00658mmHg at 25°C

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

Methods of 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.

Uses

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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