Phenylacetaldoxime
TL;DR: Phenylacetaldoxime (CAS 7028-48-0) is a chemical compound with molecular formula C8H9NO and molecular weight 135.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-phenylethylidene)hydroxylamine
Also Known As: Phenylacetaldoxime, Benzeneacetaldehyde, oxime, Phenylacetaldehyde oxime, benzylnitrone, phenylethanal oxime
| Molecular Formula | C8H9NO |
|---|---|
| Molecular Weight | 135.07 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 32.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 135.06842 |
| Heavy Atoms | 10 |
| Complexity | 106.0 |
Chemical Identifiers
| CAS Number | 7028-48-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC=NO |
| InChIKey | CXISHLWVCSLKOJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phenylacetaldoxime (CAS 7028-48-0), with molecular formula C8H9NO and molecular weight 135.07 g/mol. IUPAC: N-(2-phenylethylidene)hydroxylamine.
Chemical Property Profile of Phenylacetaldoxime
Property Insights of Phenylacetaldoxime
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenylacetaldoxime. With a topological polar surface area (TPSA) of 32.6 Ų, Phenylacetaldoxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenylacetaldoxime 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
Frequently Asked Questions
What is the CAS number of Phenylacetaldoxime?
The CAS number of Phenylacetaldoxime is 7028-48-0.
What is the molecular formula of Phenylacetaldoxime?
The molecular formula of Phenylacetaldoxime is C8H9NO.
What is the molecular weight of Phenylacetaldoxime?
The molecular weight of Phenylacetaldoxime is 135.07 g/mol.
Where can I buy Phenylacetaldoxime?
You can request a quote for Phenylacetaldoxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenylacetaldoxime?
Yes, KEHONG BIO provides custom synthesis services for Phenylacetaldoxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.