5-Ethylpyridine-2-carboxylic Acid - CAS 770-08-1
Catalog: |
BB035783 |
Product Name: |
5-Ethylpyridine-2-carboxylic Acid |
CAS: |
770-08-1 |
Synonyms: |
5-ethyl-2-pyridinecarboxylic acid; 5-ethylpyridine-2-carboxylic acid |
IUPAC Name: | 5-ethylpyridine-2-carboxylic acid |
Description: | 5-Ethylpyridine-2-carboxylic Acid (CAS# 770-08-1) is a compound useful in organic synthesis. |
Molecular Weight: | 151.16 |
Molecular Formula: | C8H9NO2 |
Canonical SMILES: | CCC1=CN=C(C=C1)C(=O)O |
InChI: | InChI=1S/C8H9NO2/c1-2-6-3-4-7(8(10)11)9-5-6/h3-5H,2H2,1H3,(H,10,11) |
InChI Key: | SHCDHIRSCJOUBW-UHFFFAOYSA-N |
Boiling Point: | 306.3 °C at 760 mmHg |
Density: | 1.18 g/cm3 |
LogP: | 1.34220 |
Publication Number | Title | Priority Date |
AU-2018360857-A1 | Modulators of the integrated stress pathway | 20171102 |
TW-201927756-A | Integrating stress pathway regulator | 20171102 |
WO-2019090076-A1 | Modulators of the integrated stress pathway | 20171102 |
EP-3710428-A1 | Modulators of the integrated stress pathway | 20171102 |
KR-20200096522-A | Modulators of the integrated stress pathway | 20171102 |
Complexity: | 147 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 151.06332853 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 151.06332853 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 50.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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