N-亚甲基苯胺
TL;DR: N-亚甲基苯胺 (CAS 100-62-9) is a chemical compound with molecular formula C7H7N and molecular weight 105.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-亚甲基苯胺
N-phenylmethanimine
Also Known As: N-Methyleneaniline, N-phenylmethanimine, N-methylenebenzenamine, Methylenanilin, N-methylenanilin
| Molecular Formula | C7H7N |
|---|---|
| Molecular Weight | 105.06 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 12.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 105.057846 |
| Heavy Atoms | 8 |
| Complexity | 72.0 |
Chemical Identifiers
| CAS Number | 100-62-9 |
|---|---|
| SMILES | C=NC1=CC=CC=C1 |
| InChIKey | VULHYRAYXYTONQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-亚甲基苯胺 (CAS 100-62-9), with molecular formula C7H7N and molecular weight 105.06 g/mol. IUPAC: N-phenylmethanimine.
Chemical Property Profile of N-亚甲基苯胺
Property Insights of N-亚甲基苯胺
The XLogP value of 3.0 indicates that N-亚甲基苯胺 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.4 Ų, N-亚甲基苯胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-亚甲基苯胺 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-亚甲基苯胺?
The CAS number of N-亚甲基苯胺 is 100-62-9.
What is the molecular formula of N-亚甲基苯胺?
The molecular formula of N-亚甲基苯胺 is C7H7N.
What is the molecular weight of N-亚甲基苯胺?
The molecular weight of N-亚甲基苯胺 is 105.06 g/mol.
Where can I buy N-亚甲基苯胺?
You can request a quote for N-亚甲基苯胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-亚甲基苯胺?
Yes, KEHONG BIO provides custom synthesis services for N-亚甲基苯胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.