RefChem:1054670
TL;DR: RefChem:1054670 (CAS 2238-81-5) is a chemical compound with molecular formula C16H26ClNO2 and molecular weight 299.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-hydroxy-3-(4-methoxyphenyl)-5-methylhex-5-enyl]-dimethylazanium chloride
Also Known As: Benzyl alcohol, alpha-(2-(dimethylamino)ethyl)-p-methoxy-alpha-(2-methylallyl)-, hydrochloride, alpha-(2-(Dimethylamino)ethyl)-p-methoxy-alpha-(2-methylallyl)benzyl alcohol hydrochloride, [3-hydroxy-3-(4-methoxyphenyl)-5-methylhex-5-enyl]-dimethylazanium chloride, [3-Hydroxy-3-(4-methoxyphenyl)-5-methylhex-5-enyl]-dimethylazaniumchloride, [3-hydroxy-3-(4-methoxyphenyl)-5-methylhex-5-enyl]-dimethylazanium,chloride
| Molecular Formula | C16H26ClNO2 |
|---|---|
| Molecular Weight | 299.17 g/mol |
| LogP | -1.61 |
| Topological Polar Surface Area | 33.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 299.1652 |
| Heavy Atoms | 20 |
| Complexity | 282.0 |
Chemical Identifiers
| CAS Number | 2238-81-5 |
|---|---|
| SMILES | CC(=C)CC(CC[NH+](C)C)(C1=CC=C(C=C1)OC)O.[Cl-] |
| InChIKey | GBEMSMUVOHWPLX-UHFFFAOYSA-N |
Product Overview
RefChem:1054670 (CAS 2238-81-5), with molecular formula C16H26ClNO2 and molecular weight 299.17 g/mol. IUPAC: [3-hydroxy-3-(4-methoxyphenyl)-5-methylhex-5-enyl]-dimethylazanium chloride.
Chemical Property Profile of RefChem:1054670
Property Insights of RefChem:1054670
The XLogP value of -1.61 indicates that RefChem:1054670 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 33.9 Ų, RefChem:1054670 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1054670 has 2 hydrogen bond donor(s) and 3 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 RefChem:1054670?
The CAS number of RefChem:1054670 is 2238-81-5.
What is the molecular formula of RefChem:1054670?
The molecular formula of RefChem:1054670 is C16H26ClNO2.
What is the molecular weight of RefChem:1054670?
The molecular weight of RefChem:1054670 is 299.17 g/mol.
Where can I buy RefChem:1054670?
You can request a quote for RefChem:1054670 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1054670?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1054670 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.