1-(2-Methoxyethyl)pyrazole-3-carboxylic Acid - CAS 936249-32-0
Catalog: |
BB040994 |
Product Name: |
1-(2-Methoxyethyl)pyrazole-3-carboxylic Acid |
CAS: |
936249-32-0 |
Synonyms: |
1-(2-methoxyethyl)-3-pyrazolecarboxylic acid; 1-(2-methoxyethyl)pyrazole-3-carboxylic acid |
IUPAC Name: | 1-(2-methoxyethyl)pyrazole-3-carboxylic acid |
Description: | 1-(2-Methoxyethyl)pyrazole-3-carboxylic Acid (CAS# 936249-32-0) is a useful research chemical. |
Molecular Weight: | 170.17 |
Molecular Formula: | C7H10N2O3 |
Canonical SMILES: | COCCN1C=CC(=N1)C(=O)O |
InChI: | InChI=1S/C7H10N2O3/c1-12-5-4-9-3-2-6(8-9)7(10)11/h2-3H,4-5H2,1H3,(H,10,11) |
InChI Key: | TZXBGMDXAVJZAQ-UHFFFAOYSA-N |
LogP: | 0.22770 |
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 |
WO-2019154950-A1 | Fused thiophene derivatives and their uses | 20180208 |
EP-3749659-A1 | Fused thiophene derivatives and their uses | 20180208 |
IL-275905-D0 | History of merged thiophs and their uses | 20180208 |
US-2020361924-A1 | Fused thiophene derivatives and their uses | 20180208 |
KR-20200141436-A | Fused thiophene derivatives and uses thereof | 20180208 |
Complexity: | 163 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 170.06914219 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 170.06914219 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 64.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.1 |
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