2-Phenyl-4-pentyn-2-ol - CAS 6712-35-2
Catalog: |
BB033196 |
Product Name: |
2-Phenyl-4-pentyn-2-ol |
CAS: |
6712-35-2 |
Synonyms: |
2-phenyl-4-pentyn-2-ol; 2-phenylpent-4-yn-2-ol |
IUPAC Name: | 2-phenylpent-4-yn-2-ol |
Description: | 2-Phenyl-4-pentyn-2-ol (CAS# 6712-35-2 ) is a useful research chemical. |
Molecular Weight: | 160.21 |
Molecular Formula: | C11H12O |
Canonical SMILES: | CC(CC#C)(C1=CC=CC=C1)O |
InChI: | InChI=1S/C11H12O/c1-3-9-11(2,12)10-7-5-4-6-8-10/h1,4-8,12H,9H2,2H3 |
InChI Key: | PLUHTHABGAEVIL-UHFFFAOYSA-N |
LogP: | 1.91740 |
Publication Number | Title | Priority Date |
US-2017197924-A1 | Novel 1,2,3 Triazole Antifungal Agents and Preparation Thereof | 20140620 |
US-9981923-B2 | 1,2,3 Triazole antifungal agents and preparation thereof | 20140620 |
WO-2015193915-A1 | Novel 1,2,3 triazole antifungal agents and preparation thereof | 20140620 |
CN-101386561-A | Method for preparing halogenated allenes | 20081104 |
CN-1468055-A | Phenylpropynyloxypyridine herbicides | 20001003 |
Complexity: | 182 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 160.088815002 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 160.088815002 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 20.2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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