1-(4-chlorophenyl)-N-phenylmethanimine oxide
TL;DR: 1-(4-chlorophenyl)-N-phenylmethanimine oxide (CAS 5909-74-0) is a chemical compound with molecular formula C13H10ClNO and molecular weight 231.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-N-phenylmethanimine oxide
Also Known As: N-phenyl-c-(4-chlorophenyl)nitrone, alpha-p-chlorophenyl-N-phenylnitrone, 1-(4-chlorophenyl)-N-phenylmethanimine oxide, Nitrone, .alpha.-(p-chlorophenyl)-N-phenyl-, Benzenamine, N-[(4-chlorophenyl)methylene]-, N-oxide
| Molecular Formula | C13H10ClNO |
|---|---|
| Molecular Weight | 231.05 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 28.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 231.04509 |
| Heavy Atoms | 16 |
| Complexity | 240.0 |
Chemical Identifiers
| CAS Number | 5909-74-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)[N+](=CC2=CC=C(C=C2)Cl)[O-] |
| InChIKey | JYXDRMQUJFWNKR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(4-chlorophenyl)-N-phenylmethanimine oxide (CAS 5909-74-0), with molecular formula C13H10ClNO and molecular weight 231.05 g/mol. IUPAC: 1-(4-chlorophenyl)-N-phenylmethanimine oxide.
Chemical Property Profile of 1-(4-chlorophenyl)-N-phenylmethanimine oxide
Property Insights of 1-(4-chlorophenyl)-N-phenylmethanimine oxide
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-chlorophenyl)-N-phenylmethanimine oxide. With a topological polar surface area (TPSA) of 28.8 Ų, 1-(4-chlorophenyl)-N-phenylmethanimine oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-chlorophenyl)-N-phenylmethanimine oxide 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 1-(4-chlorophenyl)-N-phenylmethanimine oxide?
The CAS number of 1-(4-chlorophenyl)-N-phenylmethanimine oxide is 5909-74-0.
What is the molecular formula of 1-(4-chlorophenyl)-N-phenylmethanimine oxide?
The molecular formula of 1-(4-chlorophenyl)-N-phenylmethanimine oxide is C13H10ClNO.
What is the molecular weight of 1-(4-chlorophenyl)-N-phenylmethanimine oxide?
The molecular weight of 1-(4-chlorophenyl)-N-phenylmethanimine oxide is 231.05 g/mol.
Where can I buy 1-(4-chlorophenyl)-N-phenylmethanimine oxide?
You can request a quote for 1-(4-chlorophenyl)-N-phenylmethanimine oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-chlorophenyl)-N-phenylmethanimine oxide?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-chlorophenyl)-N-phenylmethanimine oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.