p-Methoxybenzylidene-butyl-amine
TL;DR: p-Methoxybenzylidene-butyl-amine (CAS 3910-55-2) is a chemical compound with molecular formula C12H17NO and molecular weight 191.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butyl-1-(4-methoxyphenyl)methanimine
Also Known As: p-methoxybenzylidene-butyl-amine, N-(4-Methoxybenzylidene)butylamine, N-butyl-1-(4-methoxyphenyl)methanimine, N-Butyl-4-methoxybenzenemethaneimine, N-(4-Methoxybenzylidene)butane-1-amine
| Molecular Formula | C12H17NO |
|---|---|
| Molecular Weight | 191.13 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 21.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 191.13101 |
| Heavy Atoms | 14 |
| Complexity | 160.0 |
Chemical Identifiers
| CAS Number | 3910-55-2 |
|---|---|
| SMILES | CCCCN=CC1=CC=C(C=C1)OC |
| InChIKey | RYTXIPUXGFCMPB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
p-Methoxybenzylidene-butyl-amine (CAS 3910-55-2), with molecular formula C12H17NO and molecular weight 191.13 g/mol. IUPAC: N-butyl-1-(4-methoxyphenyl)methanimine.
Chemical Property Profile of p-Methoxybenzylidene-butyl-amine
Property Insights of p-Methoxybenzylidene-butyl-amine
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for p-Methoxybenzylidene-butyl-amine. With a topological polar surface area (TPSA) of 21.6 Ų, p-Methoxybenzylidene-butyl-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, p-Methoxybenzylidene-butyl-amine has 0 hydrogen bond donor(s) and 2 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 p-Methoxybenzylidene-butyl-amine?
The CAS number of p-Methoxybenzylidene-butyl-amine is 3910-55-2.
What is the molecular formula of p-Methoxybenzylidene-butyl-amine?
The molecular formula of p-Methoxybenzylidene-butyl-amine is C12H17NO.
What is the molecular weight of p-Methoxybenzylidene-butyl-amine?
The molecular weight of p-Methoxybenzylidene-butyl-amine is 191.13 g/mol.
Where can I buy p-Methoxybenzylidene-butyl-amine?
You can request a quote for p-Methoxybenzylidene-butyl-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for p-Methoxybenzylidene-butyl-amine?
Yes, KEHONG BIO provides custom synthesis services for p-Methoxybenzylidene-butyl-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.