Ethyl 4-Methylpyrazole-3-carboxylate - CAS 6076-12-6
Catalog: |
BB030797 |
Product Name: |
Ethyl 4-Methylpyrazole-3-carboxylate |
CAS: |
6076-12-6 |
Synonyms: |
4-methyl-1H-pyrazole-5-carboxylic acid ethyl ester; ethyl 4-methyl-1H-pyrazole-5-carboxylate |
IUPAC Name: | ethyl 4-methyl-1H-pyrazole-5-carboxylate |
Description: | Ethyl 4-Methylpyrazole-3-carboxylate (CAS# 6076-12-6) is a useful research chemical. |
Molecular Weight: | 154.17 |
Molecular Formula: | C7H10N2O2 |
Canonical SMILES: | CCOC(=O)C1=C(C=NN1)C |
InChI: | InChI=1S/C7H10N2O2/c1-3-11-7(10)6-5(2)4-8-9-6/h4H,3H2,1-2H3,(H,8,9) |
InChI Key: | QIBGZMYYGTXSQD-UHFFFAOYSA-N |
LogP: | 0.89480 |
Publication Number | Title | Priority Date |
WO-2021181122-A1 | Gpr52 modulator compounds | 20200313 |
WO-2021163254-A1 | Heterocyclic pad4 inhibitors | 20200212 |
WO-2021068943-A1 | Substituted nitrogen heterocyclic compound and anesthetic effect thereof | 20191011 |
WO-2020227101-A1 | Kcnt1 inhibitors and methods of use | 20190503 |
WO-2020216920-A1 | N-((heteroaryl)methyl)-1-tosyl-1h-pyrazole-3-carboxamide derivatives as kv3 potassium channel activators for treating neurological and psychiatric disorders | 20190426 |
Complexity: | 149 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 154.074227566 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 154.074227566 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 55 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.1 |
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Pyrazoles
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