Isonitrosoacetophenone
TL;DR: Isonitrosoacetophenone (CAS 22668-53-7) is a chemical compound with molecular formula C8H7NO2 and molecular weight 149.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E)-2-hydroxyimino-1-phenylethanone
Also Known As: 2-Isonitrosoacetophenone, Isonitrosoacetophenone, Benzoylformaldoxime, Phenylglyoxal aldoxime, Phenylglyoxal 2-oxime
| Molecular Formula | C8H7NO2 |
|---|---|
| Molecular Weight | 149.05 g/mol |
| LogP | 1.3293 |
| Topological Polar Surface Area | 49.66 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 149.04768 |
| Heavy Atoms | 11 |
| Complexity | 266.68036 |
Chemical Identifiers
| CAS Number | 22668-53-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)/C=N/O |
Product Overview
Isonitrosoacetophenone (CAS 22668-53-7), with molecular formula C8H7NO2 and molecular weight 149.05 g/mol. IUPAC: (2E)-2-hydroxyimino-1-phenylethanone.
Chemical Property Profile of Isonitrosoacetophenone
Property Insights of Isonitrosoacetophenone
The XLogP value of 1.3293 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isonitrosoacetophenone. With a topological polar surface area (TPSA) of 49.66 Ų, Isonitrosoacetophenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isonitrosoacetophenone 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
Frequently Asked Questions
What is the CAS number of Isonitrosoacetophenone?
The CAS number of Isonitrosoacetophenone is 22668-53-7.
What is the molecular formula of Isonitrosoacetophenone?
The molecular formula of Isonitrosoacetophenone is C8H7NO2.
What is the molecular weight of Isonitrosoacetophenone?
The molecular weight of Isonitrosoacetophenone is 149.05 g/mol.
Where can I buy Isonitrosoacetophenone?
You can request a quote for Isonitrosoacetophenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isonitrosoacetophenone?
Yes, KEHONG BIO provides custom synthesis services for Isonitrosoacetophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.