(+-)-Benzoin oxime
TL;DR: (+-)-Benzoin oxime (CAS 441-38-3) is a chemical compound with molecular formula C14H13NO2 and molecular weight 227.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxyimino-1,2-diphenylethanol
Also Known As: alpha-Benzoin oxime, Cupron, Benzoin oxime, Benzoinoxim, Benzoinoxime
| Molecular Formula | C14H13NO2 |
|---|---|
| Molecular Weight | 227.09 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 52.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 227.09464 |
| Heavy Atoms | 17 |
| Complexity | 253.0 |
Chemical Identifiers
| CAS Number | 441-38-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(C(=NO)C2=CC=CC=C2)O |
| InChIKey | WAKHLWOJMHVUJC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(+-)-Benzoin oxime (CAS 441-38-3), with molecular formula C14H13NO2 and molecular weight 227.09 g/mol. IUPAC: 2-hydroxyimino-1,2-diphenylethanol.
Chemical Property Profile of (+-)-Benzoin oxime
Property Insights of (+-)-Benzoin oxime
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (+-)-Benzoin oxime. With a topological polar surface area (TPSA) of 52.8 Ų, (+-)-Benzoin oxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (+-)-Benzoin oxime has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (+-)-Benzoin oxime?
The CAS number of (+-)-Benzoin oxime is 441-38-3.
What is the molecular formula of (+-)-Benzoin oxime?
The molecular formula of (+-)-Benzoin oxime is C14H13NO2.
What is the molecular weight of (+-)-Benzoin oxime?
The molecular weight of (+-)-Benzoin oxime is 227.09 g/mol.
Where can I buy (+-)-Benzoin oxime?
You can request a quote for (+-)-Benzoin oxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (+-)-Benzoin oxime?
Yes, KEHONG BIO provides custom synthesis services for (+-)-Benzoin oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.