RefChem:368827
TL;DR: RefChem:368827 (CAS 16809-59-9) is a chemical compound with molecular formula C14H23Cl2NO and molecular weight 291.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chloro-5-methyl-2-propan-2-ylphenoxy)-N,N-dimethylethanamine;hydrochloride
Also Known As: Phenetole, 4-chloro-beta-(N,N-dimethylamino)-2-isopropyl-5-methyl-, hydrochloride, p-Cymene, 2-chloro-5-(2-(dimethylamino)ethoxy)-, hydrochloride, 4-Chloro-beta-(N,N-dimethylamino)-2-isopropyl-5-methylphenetole hydrochloride, Ethylamine, 2-[(6-chlorothymyl)oxy]-N,N-dimethyl-, hydrochloride, 2-(4-Chloro-2-isopropyl-5-methylphenoxy)-N,N-dimethylethan-1-amine Hydrochloride
| Molecular Formula | C14H23Cl2NO |
|---|---|
| Molecular Weight | 291.12 g/mol |
| LogP | 4.13402 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 291.11566 |
| Heavy Atoms | 18 |
| Complexity | 220.0 |
Chemical Identifiers
| CAS Number | 16809-59-9 |
|---|---|
| SMILES | CC1=CC(=C(C=C1Cl)C(C)C)OCCN(C)C.Cl |
| InChIKey | APDBPWWUCXTXGD-UHFFFAOYSA-N |
Product Overview
RefChem:368827 (CAS 16809-59-9), with molecular formula C14H23Cl2NO and molecular weight 291.12 g/mol. IUPAC: 2-(4-chloro-5-methyl-2-propan-2-ylphenoxy)-N,N-dimethylethanamine;hydrochloride.
Chemical Property Profile of RefChem:368827
Property Insights of RefChem:368827
The XLogP value of 4.13402 indicates that RefChem:368827 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.5 Ų, RefChem:368827 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:368827 has 1 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 RefChem:368827?
The CAS number of RefChem:368827 is 16809-59-9.
What is the molecular formula of RefChem:368827?
The molecular formula of RefChem:368827 is C14H23Cl2NO.
What is the molecular weight of RefChem:368827?
The molecular weight of RefChem:368827 is 291.12 g/mol.
Where can I buy RefChem:368827?
You can request a quote for RefChem:368827 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:368827?
Yes, KEHONG BIO provides custom synthesis services for RefChem:368827 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.