2-(2-Fluorophenyl)-2-hydroxyacetonitrile
TL;DR: 2-(2-Fluorophenyl)-2-hydroxyacetonitrile (CAS 133721-88-7) is a chemical compound with molecular formula C8H6FNO and molecular weight 151.04333 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2-fluorophenyl)-2-hydroxyacetonitrile
Also Known As: 2-(2-Fluorophenyl)-2-hydroxyacetonitrile, 2-fluorobenzaldehyde cyanohydrin, 2-Fluoro-alpha-hydroxybenzeneacetonitrile, (2-Fluorophenyl)(hydroxy)acetonitrile, 2-(2-fluorophenyl)-2-hydroxy-acetonitrile
Technical Specifications
| Molecular Formula | C8H6FNO |
| Molecular Weight | 151.04333 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 44.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 151.04333 Da |
| Heavy Atoms | 11 |
| Complexity | 174.0 |
| SMILES | C1=CC=C(C(=C1)C(C#N)O)F |
| InChIKey | SDADKJCPTQNFRZ-UHFFFAOYSA-N |
Chemical Property Profile of 2-(2-Fluorophenyl)-2-hydroxyacetonitrile
Property Insights of 2-(2-Fluorophenyl)-2-hydroxyacetonitrile
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Fluorophenyl)-2-hydroxyacetonitrile. With a topological polar surface area (TPSA) of 44.0 Ų, 2-(2-Fluorophenyl)-2-hydroxyacetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Fluorophenyl)-2-hydroxyacetonitrile has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(2-Fluorophenyl)-2-hydroxyacetonitrile?
The CAS number of 2-(2-Fluorophenyl)-2-hydroxyacetonitrile is 133721-88-7.
What is the molecular formula of 2-(2-Fluorophenyl)-2-hydroxyacetonitrile?
The molecular formula of 2-(2-Fluorophenyl)-2-hydroxyacetonitrile is C8H6FNO.
What is the molecular weight of 2-(2-Fluorophenyl)-2-hydroxyacetonitrile?
The molecular weight of 2-(2-Fluorophenyl)-2-hydroxyacetonitrile is 151.04333 g/mol.
Where can I buy 2-(2-Fluorophenyl)-2-hydroxyacetonitrile?
You can request a quote for 2-(2-Fluorophenyl)-2-hydroxyacetonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(2-Fluorophenyl)-2-hydroxyacetonitrile?
Yes, CoreyChem provides custom synthesis services for 2-(2-Fluorophenyl)-2-hydroxyacetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.