1,4-Dimethyl-1H-pyrazole-5-carboxylic Acid - CAS 13745-58-9
Catalog: |
BB008571 |
Product Name: |
1,4-Dimethyl-1H-pyrazole-5-carboxylic Acid |
CAS: |
13745-58-9 |
Synonyms: |
2,4-dimethyl-3-pyrazolecarboxylic acid; 2,4-dimethylpyrazole-3-carboxylic acid |
IUPAC Name: | 2,4-dimethylpyrazole-3-carboxylic acid |
Description: | 1,4-Dimethyl-1H-pyrazole-5-carboxylic Acid (CAS# 13745-58-9) is a useful research chemical. |
Molecular Weight: | 140.14 |
Molecular Formula: | C6H8N2O2 |
Canonical SMILES: | CC1=C(N(N=C1)C)C(=O)O |
InChI: | InChI=1S/C6H8N2O2/c1-4-3-7-8(2)5(4)6(9)10/h3H,1-2H3,(H,9,10) |
InChI Key: | FYWSABALQBFSCW-UHFFFAOYSA-N |
Storage: | Sealed in dry, 2-8 °C |
LogP: | 0.42670 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
EP-3822268-A1 | Substituted hydantoinamides as adamts7 antagonists | 20191115 |
WO-2021094436-A1 | Substituted hydantoinamides as adamts7 antagonists | 20191115 |
WO-2020018848-A1 | Methods of culturing and/or expanding stem cells and/or lineage committed progenitor cells using amido compounds | 20180719 |
TW-202014419-A | Nicotine Acetylcholine Receptor Spiroperidine Ectopic Regulator | 20180501 |
BR-112020022088-A2 | allosteric spiropiperidine modulators of nicotinic acetylcholine receptors | 20180501 |
Complexity: | 149 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 140.058577502 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 140.058577502 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 55.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.5 |
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