N-Butylidenebutylamine
TL;DR: N-Butylidenebutylamine (CAS 4853-56-9) is a chemical compound with molecular formula C8H17N and molecular weight 127.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butylbutan-1-imine
Also Known As: N-Butylidenebutylamine, N-Butylidene-1-butanamine, butyl(butylidene)amine, N-butylbutan-1-imine, Butylamine, N-butylidene-
| Molecular Formula | C8H17N |
|---|---|
| Molecular Weight | 127.14 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 12.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 127.1361 |
| Heavy Atoms | 9 |
| Complexity | 67.0 |
Chemical Identifiers
| CAS Number | 4853-56-9 |
|---|---|
| SMILES | CCCCN=CCCC |
| InChIKey | GMYLJUMIAPOWOO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-Butylidenebutylamine (CAS 4853-56-9), with molecular formula C8H17N and molecular weight 127.14 g/mol. IUPAC: N-butylbutan-1-imine.
Chemical Property Profile of N-Butylidenebutylamine
Property Insights of N-Butylidenebutylamine
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Butylidenebutylamine. With a topological polar surface area (TPSA) of 12.4 Ų, N-Butylidenebutylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Butylidenebutylamine 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-Butylidenebutylamine?
The CAS number of N-Butylidenebutylamine is 4853-56-9.
What is the molecular formula of N-Butylidenebutylamine?
The molecular formula of N-Butylidenebutylamine is C8H17N.
What is the molecular weight of N-Butylidenebutylamine?
The molecular weight of N-Butylidenebutylamine is 127.14 g/mol.
Where can I buy N-Butylidenebutylamine?
You can request a quote for N-Butylidenebutylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Butylidenebutylamine?
Yes, KEHONG BIO provides custom synthesis services for N-Butylidenebutylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.