4-Phenylbutylammonium chloride
TL;DR: 4-Phenylbutylammonium chloride (CAS 30684-06-1) is a chemical compound with molecular formula C11H19N and molecular weight 165.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methane;4-phenylbutan-1-amine
Also Known As: 4-Phenylbutylammonium chloride, 4-Phenylbutylamine Hydrochloride, methane; 4-phenylbutan-1-amine, 4-Phenylbutan-1-amine--methane (1/1)
| Molecular Formula | C11H19N |
|---|---|
| Molecular Weight | 165.15 g/mol |
| LogP | 2.6041 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 165.15175 |
| Heavy Atoms | 12 |
| Complexity | 84.0 |
Chemical Identifiers
| CAS Number | 30684-06-1 |
|---|---|
| SMILES | C.C1=CC=C(C=C1)CCCCN |
| InChIKey | VGECFYQRUARHKB-UHFFFAOYSA-N |
Product Overview
4-Phenylbutylammonium chloride (CAS 30684-06-1), with molecular formula C11H19N and molecular weight 165.15 g/mol. IUPAC: methane;4-phenylbutan-1-amine.
Chemical Property Profile of 4-Phenylbutylammonium chloride
Property Insights of 4-Phenylbutylammonium chloride
The XLogP value of 2.6041 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Phenylbutylammonium chloride. With a topological polar surface area (TPSA) of 26.0 Ų, 4-Phenylbutylammonium chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Phenylbutylammonium chloride has 1 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 4-Phenylbutylammonium chloride?
The CAS number of 4-Phenylbutylammonium chloride is 30684-06-1.
What is the molecular formula of 4-Phenylbutylammonium chloride?
The molecular formula of 4-Phenylbutylammonium chloride is C11H19N.
What is the molecular weight of 4-Phenylbutylammonium chloride?
The molecular weight of 4-Phenylbutylammonium chloride is 165.15 g/mol.
Where can I buy 4-Phenylbutylammonium chloride?
You can request a quote for 4-Phenylbutylammonium chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Phenylbutylammonium chloride?
Yes, KEHONG BIO provides custom synthesis services for 4-Phenylbutylammonium chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.