1-(3-Pyridyl)-2-propyn-1-ol - CAS 276884-35-6
Catalog: |
BB019647 |
Product Name: |
1-(3-Pyridyl)-2-propyn-1-ol |
CAS: |
276884-35-6 |
Synonyms: |
1-(3-pyridinyl)-2-propyn-1-ol; 1-pyridin-3-ylprop-2-yn-1-ol |
IUPAC Name: | 1-pyridin-3-ylprop-2-yn-1-ol |
Description: | 1-(3-Pyridyl)-2-propyn-1-ol (CAS# 276884-35-6 ) is a useful research chemical. |
Molecular Weight: | 133.15 |
Molecular Formula: | C8H7NO |
Canonical SMILES: | C#CC(C1=CN=CC=C1)O |
InChI: | InChI=1S/C8H7NO/c1-2-8(10)7-4-3-5-9-6-7/h1,3-6,8,10H |
InChI Key: | YQEHAHXOJGYJDW-UHFFFAOYSA-N |
LogP: | 0.74820 |
Publication Number | Title | Priority Date |
WO-2020114494-A1 | Ret inhibitors, pharmaceutical compositions and uses thereof | 20181207 |
AU-2012357067-A1 | Novel dihydropyrimidinoisoquinolinones and pharmaceutical compositions thereof for the treatment of inflammatory disorders | 20111222 |
CA-2859578-A1 | Dihydropyrimidinoisoquinolinones and pharmaceutical compositions thereof for the treatment of inflammatory disorders. | 20111222 |
CA-2859578-C | Dihydropyrimidinoisoquinolinones and pharmaceutical compositions thereof for the treatment of inflammatory disorders. | 20111222 |
EP-2794604-B1 | Novel dihydropyrimidinoisoquinolinones and pharmaceutical compositions thereof for the treatment of inflammatory disorders | 20111222 |
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: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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