1H-Pyrazole-4-carboxylic acid, 3-methyl-, ethyl ester
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1H-Pyrazole-4-carboxylic acid, 3-methyl-, ethyl ester
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CAS No:
85290-78-4
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Formula:
C7H10N2O2
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Chemical Name:
1H-Pyrazole-4-carboxylic acid, 3-methyl-, ethyl ester
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Synonyms:
1H-Pyrazole-4-carboxylic acid,3-methyl-,ethyl ester;Pyrazole-4-carboxylic acid,3(or 5)-methyl-,ethyl ester;Ethyl 3-methylpyrazole-4-carboxylate;Ethyl 3-methyl-1H-pyrazole-4-carboxylate;3-Methyl-1H-pyrazole-4-carboxylic acid ethyl ester;NSC 19454;161958-17-4;861585-81-1;1487118-48-8
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CAS No:
Characteristics
55 Ų
1.171±0.06 g/cm3
80 °C @ Solvent: Ethyl acetate, Ligroine
280.6±20.0 °C(Predicted)
12.26±0.50
Safety Information
3
|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|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
1H-Pyrazole-4-carboxylic acid, 3-methyl-, ethyl ester Use and Manufacturing
Shows systemic antifungal activity accompanied by high levels of phytotoxicity
Computed Properties
Molecular Weight:154.17
XLogP3:0.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:154.074227566
Monoisotopic Mass:154.074227566
Topological Polar Surface Area:55
Heavy Atom Count:11
Complexity:149
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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CN
5 YRS
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