Diphenylnitrone
TL;DR: Diphenylnitrone (CAS 1137-96-8) is a chemical compound with molecular formula C13H11NO and molecular weight 197.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,1-diphenylmethanimine oxide
Also Known As: Diphenylnitrone, C,N-Diphenylnitrone, N,1-diphenylmethanimine oxide, alpha,N-Diphenylnitrone, Benzaldehydephenylnitrone
| Molecular Formula | C13H11NO |
|---|---|
| Molecular Weight | 197.08 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 28.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 197.08406 |
| Heavy Atoms | 15 |
| Complexity | 213.0 |
Chemical Identifiers
| CAS Number | 1137-96-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C=[N+](C2=CC=CC=C2)[O-] |
| InChIKey | ZEAUJQWDPKRESH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Diphenylnitrone (CAS 1137-96-8), with molecular formula C13H11NO and molecular weight 197.08 g/mol. IUPAC: N,1-diphenylmethanimine oxide.
Chemical Property Profile of Diphenylnitrone
Property Insights of Diphenylnitrone
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diphenylnitrone. With a topological polar surface area (TPSA) of 28.8 Ų, Diphenylnitrone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diphenylnitrone has 0 hydrogen bond donor(s) and 1 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 Diphenylnitrone?
The CAS number of Diphenylnitrone is 1137-96-8.
What is the molecular formula of Diphenylnitrone?
The molecular formula of Diphenylnitrone is C13H11NO.
What is the molecular weight of Diphenylnitrone?
The molecular weight of Diphenylnitrone is 197.08 g/mol.
Where can I buy Diphenylnitrone?
You can request a quote for Diphenylnitrone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diphenylnitrone?
Yes, KEHONG BIO provides custom synthesis services for Diphenylnitrone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.