Ethyl 3-tert-Butyl-1-methylpyrazole-5-carboxylate - CAS 133261-10-6
Catalog: |
BB007717 |
Product Name: |
Ethyl 3-tert-Butyl-1-methylpyrazole-5-carboxylate |
CAS: |
133261-10-6 |
Synonyms: |
5-tert-butyl-2-methyl-3-pyrazolecarboxylic acid ethyl ester; ethyl 5-tert-butyl-2-methylpyrazole-3-carboxylate |
IUPAC Name: | ethyl 5-tert-butyl-2-methylpyrazole-3-carboxylate |
Description: | Ethyl 3-tert-Butyl-1-methylpyrazole-5-carboxylate (CAS# 133261-10-6) is a useful research chemical. |
Molecular Weight: | 210.27 |
Molecular Formula: | C11H18N2O2 |
Canonical SMILES: | CCOC(=O)C1=CC(=NN1C)C(C)(C)C |
InChI: | InChI=1S/C11H18N2O2/c1-6-15-10(14)8-7-9(11(2,3)4)12-13(8)5/h7H,6H2,1-5H3 |
InChI Key: | JCOHRMJIHAFFBC-UHFFFAOYSA-N |
Boiling Point: | 299.2 °C at 760 mmHg |
Density: | 1.04 g/cm3 |
MDL: | MFCD00085059 |
LogP: | 1.89430 |
Publication Number | Title | Priority Date |
CN-103641782-A | Pyrazol acylhydrazone compounds and application thereof | 20131226 |
CN-103641782-B | Pyrazol acylhydrazone compounds and application thereof | 20131226 |
CN-103130796-A | 3-tertiary butyl pyrazole amides compounds and application thereof | 20130125 |
CN-103130796-B | A kind of 3-t-butylpyrazol amides and application thereof | 20130125 |
US-2012202856-A1 | Substituted benzimdazole derivatives useful as trpm8 receptor modulators | 20110207 |
Complexity: | 235 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 210.136827821 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 210.136827821 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 44.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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