Mandelonitrile
TL;DR: Mandelonitrile (CAS 532-28-5) is a chemical compound with molecular formula C8H7NO and molecular weight 133.05276 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-hydroxy-2-phenylacetonitrile
Also Known As: Mandelonitrile, Amygdalonitrile, Phenylglycolonitrile, Benzaldehyde cyanohydrin, Mandelic acid nitrile
Application Areas
Top 5 of 18 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H7NO |
| Molecular Weight | 133.05276 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 44.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 133.05276 Da |
| Heavy Atoms | 10 |
| Complexity | 141.0 |
| Melting Point | 14 °F (also given as 72 °F) (NTP, 1992) |
| Boiling Point | 338 °F at 760 mmHg (decomposes) (NTP, 1992) |
| Density | 1.1165 at 68 °F (NTP, 1992) - Denser than water; will sink |
| Flash Point | 179.5 °F (NTP, 1992) |
| Solubility | less than 1 mg/mL at 68 °F (NTP, 1992) |
| SMILES | C1=CC=C(C=C1)C(C#N)O |
| InChIKey | NNICRUQPODTGRU-UHFFFAOYSA-N |
Product Description
Applications: Mandelonitrile is used in complex organic molecule assembly across discovery and process chemistry, as well as biotechnology workflows and life-science research. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Mandelonitrile (CAS 532-28-5) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
Mandelonitrile (CAS 532-28-5) is a organic building block with the molecular formula C8H7NO and a molecular weight of 133.05 g/mol. Key physical properties include a density of 1.1165 at 68 °F (NTP, 1992) - Denser than water; will sink g/cm³, a solubility: less than 1 mg/mL at 68 °F (NTP, 1992). It is also known as Mandelonitrile and Amygdalonitrile.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Mandelonitrile
Property Insights of Mandelonitrile
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Mandelonitrile. With a topological polar surface area (TPSA) of 44.0 Ų, Mandelonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Mandelonitrile has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Mandelonitrile?
The CAS number of Mandelonitrile is 532-28-5.
What is the molecular formula of Mandelonitrile?
The molecular formula of Mandelonitrile is C8H7NO.
What is the molecular weight of Mandelonitrile?
The molecular weight of Mandelonitrile is 133.05276 g/mol.
What are the applications of Mandelonitrile?
Mandelonitrile is used in complex organic molecule assembly across discovery and process chemistry, as well as biotechnology workflows and life-science research. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Mandelonitrile (CAS 532-28-5) with custom...
Where can I buy Mandelonitrile?
You can request a quote for Mandelonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Mandelonitrile?
Yes, CoreyChem provides custom synthesis services for Mandelonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.