RefChem:1061799
TL;DR: RefChem:1061799 (CAS 20228-96-0) is a chemical compound with molecular formula C12H18Cl2N2O2 and molecular weight 292.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-chloro-6-methylphenyl)carbamoyloxy]ethyl-dimethylazanium chloride
Also Known As: 2-Chloro-6-methylcarbanilic acid 2-(dimethylamino)ethyl ester hydrochloride, 2-(Dimethylamino)ethyl 2-chloro-6-methylcarbanilate hydrochloride, 2-[(2-chloro-6-methylphenyl)carbamoyloxy]ethyl-dimethylazanium chloride, 2-[(2-chloro-6-methylphenyl)carbamoyloxy]ethyl-dimethylazanium;chloride, CARBANILIC ACID, 2-CHLORO-6-METHYL-, 2-(DIMETHYLAMINO)ETHYL ESTER, HYDROCHLORIDE
| Molecular Formula | C12H18Cl2N2O2 |
|---|---|
| Molecular Weight | 292.07 g/mol |
| LogP | -1.65 |
| Topological Polar Surface Area | 42.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 292.07452 |
| Heavy Atoms | 18 |
| Complexity | 249.0 |
Chemical Identifiers
| CAS Number | 20228-96-0 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)Cl)NC(=O)OCC[NH+](C)C.[Cl-] |
| InChIKey | HZKKWJABACSFEU-UHFFFAOYSA-N |
Product Overview
RefChem:1061799 (CAS 20228-96-0), with molecular formula C12H18Cl2N2O2 and molecular weight 292.07 g/mol. IUPAC: 2-[(2-chloro-6-methylphenyl)carbamoyloxy]ethyl-dimethylazanium chloride.
Chemical Property Profile of RefChem:1061799
Property Insights of RefChem:1061799
The XLogP value of -1.65 indicates that RefChem:1061799 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 42.8 Ų, RefChem:1061799 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1061799 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:1061799?
The CAS number of RefChem:1061799 is 20228-96-0.
What is the molecular formula of RefChem:1061799?
The molecular formula of RefChem:1061799 is C12H18Cl2N2O2.
What is the molecular weight of RefChem:1061799?
The molecular weight of RefChem:1061799 is 292.07 g/mol.
Where can I buy RefChem:1061799?
You can request a quote for RefChem:1061799 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1061799?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1061799 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.