| CAS Number: 342026-17-9 ethyl 3-isopropyl-1H-pyrazole-4-carboxylate |
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| General Information | ||||||
| Product Number: 342026179
CAS Registry Number: 342026-17-9
Name:
1H-Pyrazole-4-carboxylic acid, 3-(1-methylethyl)-, ethyl ester
3-(1-Methylethyl)-1H-pyrazole-4-carboxylic acid ethyl ester; Ethyl 3-isopropyl-1H-pyrazole-4-carboxylate
Chemical Formula: C9H14N2O2
Exact Mass: 182.11
Molecular Weight: 182.22
m/z: 182.11 (100.0%), 183.11 (10.0%)
Elemental Analysis: C, 59.32; H, 7.74; N, 15.37; O, 17.56
InChI: InChI=1S/C9H14N2O2/c1-3-7(2)6-13-9(12)8-4-10-11-5-8/h4-5,7H,3,6H2,1-2H3,(H,10,11)
InChIKey: FTKGVXXVKHOVTO-UHFFFAOYSA-N
Canonical SMILES : CCC(C)COC(=O)C1=CNN=C1
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Specification |
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98% |
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| References | ||||||
PCT Int. Appl. (2011), WO 2011078360 A1 20110630. PCT Int. Appl. (2008), WO 2008011131 A2 20080124. |
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