Phenol, p-(1-butyl-4-imidazolyl)-, hydrochloride
TL;DR: Phenol, p-(1-butyl-4-imidazolyl)-, hydrochloride (CAS 5336-40-3) is a chemical compound with molecular formula C13H17ClN2O and molecular weight 252.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1-butylimidazol-4-yl)phenol;hydrochloride
Also Known As: Verbindungen 335, Verbindungen 335 [German], Phenol, p-(1-butyl-4-imidazolyl)-, hydrochloride, 1-Butyl-4-(p-hydroxyphenyl)imidazole hydrochloride, Imidazole, 1-butyl-4-(p-hydroxyphenyl)-, hydrochloride
| Molecular Formula | C13H17ClN2O |
|---|---|
| Molecular Weight | 252.10 g/mol |
| LogP | 3.4776 |
| Topological Polar Surface Area | 38.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 252.10294 |
| Heavy Atoms | 17 |
| Complexity | 202.0 |
Chemical Identifiers
| CAS Number | 5336-40-3 |
|---|---|
| SMILES | CCCCN1C=C(N=C1)C2=CC=C(C=C2)O.Cl |
| InChIKey | LEPFSCBOEUIILE-UHFFFAOYSA-N |
Product Overview
Phenol, p-(1-butyl-4-imidazolyl)-, hydrochloride (CAS 5336-40-3), with molecular formula C13H17ClN2O and molecular weight 252.10 g/mol. IUPAC: 4-(1-butylimidazol-4-yl)phenol;hydrochloride.
Chemical Property Profile of Phenol, p-(1-butyl-4-imidazolyl)-, hydrochloride
Property Insights of Phenol, p-(1-butyl-4-imidazolyl)-, hydrochloride
The XLogP value of 3.4776 indicates that Phenol, p-(1-butyl-4-imidazolyl)-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.1 Ų, Phenol, p-(1-butyl-4-imidazolyl)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenol, p-(1-butyl-4-imidazolyl)-, hydrochloride has 2 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 Phenol, p-(1-butyl-4-imidazolyl)-, hydrochloride?
The CAS number of Phenol, p-(1-butyl-4-imidazolyl)-, hydrochloride is 5336-40-3.
What is the molecular formula of Phenol, p-(1-butyl-4-imidazolyl)-, hydrochloride?
The molecular formula of Phenol, p-(1-butyl-4-imidazolyl)-, hydrochloride is C13H17ClN2O.
What is the molecular weight of Phenol, p-(1-butyl-4-imidazolyl)-, hydrochloride?
The molecular weight of Phenol, p-(1-butyl-4-imidazolyl)-, hydrochloride is 252.10 g/mol.
Where can I buy Phenol, p-(1-butyl-4-imidazolyl)-, hydrochloride?
You can request a quote for Phenol, p-(1-butyl-4-imidazolyl)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenol, p-(1-butyl-4-imidazolyl)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Phenol, p-(1-butyl-4-imidazolyl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.