Benzenemethanamine,N-(phenylmethylene)-, N-oxide
TL;DR: Benzenemethanamine,N-(phenylmethylene)-, N-oxide (CAS 77681-22-2) is a chemical compound with molecular formula C14H13NO and molecular weight 211.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-1-phenylmethanimine oxide
Also Known As: c-phenyl N-benzyl nitrone, Benzyl(benzylidene)azane oxide, N-benzyl-1-phenylmethanimine oxide, N-benzylidenebenzylamine N-oxide, (Z)-N-benzyl-2-ethylideneaziridine
| Molecular Formula | C14H13NO |
|---|---|
| Molecular Weight | 211.10 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 28.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 211.09972 |
| Heavy Atoms | 16 |
| Complexity | 225.0 |
Chemical Identifiers
| CAS Number | 77681-22-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C[N+](=CC2=CC=CC=C2)[O-] |
| InChIKey | UBINNYMQZVKNFF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzenemethanamine,N-(phenylmethylene)-, N-oxide (CAS 77681-22-2), with molecular formula C14H13NO and molecular weight 211.10 g/mol. IUPAC: N-benzyl-1-phenylmethanimine oxide.
Chemical Property Profile of Benzenemethanamine,N-(phenylmethylene)-, N-oxide
Property Insights of Benzenemethanamine,N-(phenylmethylene)-, N-oxide
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenemethanamine,N-(phenylmethylene)-, N-oxide. With a topological polar surface area (TPSA) of 28.8 Ų, Benzenemethanamine,N-(phenylmethylene)-, N-oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenemethanamine,N-(phenylmethylene)-, N-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 Benzenemethanamine,N-(phenylmethylene)-, N-oxide?
The CAS number of Benzenemethanamine,N-(phenylmethylene)-, N-oxide is 77681-22-2.
What is the molecular formula of Benzenemethanamine,N-(phenylmethylene)-, N-oxide?
The molecular formula of Benzenemethanamine,N-(phenylmethylene)-, N-oxide is C14H13NO.
What is the molecular weight of Benzenemethanamine,N-(phenylmethylene)-, N-oxide?
The molecular weight of Benzenemethanamine,N-(phenylmethylene)-, N-oxide is 211.10 g/mol.
Where can I buy Benzenemethanamine,N-(phenylmethylene)-, N-oxide?
You can request a quote for Benzenemethanamine,N-(phenylmethylene)-, N-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenemethanamine,N-(phenylmethylene)-, N-oxide?
Yes, KEHONG BIO provides custom synthesis services for Benzenemethanamine,N-(phenylmethylene)-, N-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.