N-乙叉苯胺
TL;DR: N-乙叉苯胺 (CAS 6052-11-5) is a chemical compound with molecular formula C8H9N and molecular weight 119.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-乙叉苯胺
N-phenylethanimine
Also Known As: Ethylideneaniline, N-phenylethanimine, (E)-N-Ethylideneaniline, n-ethylideneaniline, (E)-N-Phenylethanimine
| Molecular Formula | C8H9N |
|---|---|
| Molecular Weight | 119.07 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 12.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 119.0735 |
| Heavy Atoms | 9 |
| Complexity | 90.0 |
Chemical Identifiers
| CAS Number | 6052-11-5 |
|---|---|
| SMILES | CC=NC1=CC=CC=C1 |
| InChIKey | BHGHXAOHFWSPNE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-乙叉苯胺 (CAS 6052-11-5), with molecular formula C8H9N and molecular weight 119.07 g/mol. IUPAC: N-phenylethanimine.
Chemical Property Profile of N-乙叉苯胺
Property Insights of N-乙叉苯胺
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-乙叉苯胺. With a topological polar surface area (TPSA) of 12.4 Ų, N-乙叉苯胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-乙叉苯胺 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 N-乙叉苯胺?
The CAS number of N-乙叉苯胺 is 6052-11-5.
What is the molecular formula of N-乙叉苯胺?
The molecular formula of N-乙叉苯胺 is C8H9N.
What is the molecular weight of N-乙叉苯胺?
The molecular weight of N-乙叉苯胺 is 119.07 g/mol.
Where can I buy N-乙叉苯胺?
You can request a quote for N-乙叉苯胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-乙叉苯胺?
Yes, KEHONG BIO provides custom synthesis services for N-乙叉苯胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.