2-(2-Pyrazinyl)-4-pentyn-2-ol - CAS 2006278-24-4
Catalog: |
BB015607 |
Product Name: |
2-(2-Pyrazinyl)-4-pentyn-2-ol |
CAS: |
2006278-24-4 |
Synonyms: |
2-(2-pyrazinyl)-4-pentyn-2-ol; 2-pyrazin-2-ylpent-4-yn-2-ol |
IUPAC Name: | 2-pyrazin-2-ylpent-4-yn-2-ol |
Description: | 2-(2-Pyrazinyl)-4-pentyn-2-ol (CAS# 2006278-24-4 ) is a useful research chemical. |
Molecular Weight: | 162.19 |
Molecular Formula: | C9H10N2O |
Canonical SMILES: | CC(CC#C)(C1=NC=CN=C1)O |
InChI: | InChI=1S/C9H10N2O/c1-3-4-9(2,12)8-7-10-5-6-11-8/h1,5-7,12H,4H2,2H3 |
InChI Key: | YXWAOHOPSHRIKD-UHFFFAOYSA-N |
LogP: | 0.70740 |
Complexity: | 196 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 162.079312947 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 162.079312947 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 46 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.3 |
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