3-(4-Pyridyl)-2-propyn-1-ol - CAS 93524-95-9
Catalog: |
BB040952 |
Product Name: |
3-(4-Pyridyl)-2-propyn-1-ol |
CAS: |
93524-95-9 |
Synonyms: |
3-pyridin-4-yl-2-propyn-1-ol; 3-pyridin-4-ylprop-2-yn-1-ol |
IUPAC Name: | 3-pyridin-4-ylprop-2-yn-1-ol |
Description: | 3-(4-Pyridyl)-2-propyn-1-ol (CAS# 93524-95-9) is a useful research chemical. |
Molecular Weight: | 133.15 |
Molecular Formula: | C8H7NO |
Canonical SMILES: | C1=CN=CC=C1C#CCO |
InChI: | InChI=1S/C8H7NO/c10-7-1-2-8-3-5-9-6-4-8/h3-6,10H,7H2 |
InChI Key: | QYFHTILWEGBMKR-UHFFFAOYSA-N |
Storage: | Keep in inert atmosphere, store at 2-8 °C. |
LogP: | 0.42540 |
Publication Number | Title | Priority Date |
CN-111285873-A | RET inhibitors, pharmaceutical compositions thereof and uses thereof | 20181207 |
CN-111285874-A | RET inhibitors, pharmaceutical compositions thereof and uses thereof | 20181207 |
WO-2020114487-A1 | Ret inhibitors, pharmaceutical compositions and uses thereof | 20181207 |
WO-2020114494-A1 | Ret inhibitors, pharmaceutical compositions and uses thereof | 20181207 |
EP-3891148-A1 | Ret inhibitors, pharmaceutical compositions and uses thereof | 20181207 |
Complexity: | 147 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 133.052763847 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 133.052763847 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 33.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.4 |
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