RefChem:318867
TL;DR: RefChem:318867 (CAS 64049-96-3) is a chemical compound with molecular formula C15H23ClN2O4 and molecular weight 330.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-ethoxy-2-oxoethyl)-dimethyl-[4-methyl-3-(methylcarbamoyloxy)phenyl]azanium chloride
Also Known As: Ammonium, (3-(methylcarbamoyloxy)-p-tolyl)dimethyl(ethoxycarbonylmethyl)-, chloride, Ammonium, (3-hydroxy-p-tolyl)dimethyl(ethoxycarbonylmethyl)-, chloride, methylcarbamate, Carbamic acid, N-methyl-, 2-methyl-5-dimethylaminophenyl ester, carbethoxymethochloride, (2-ethoxy-2-oxoethyl)-dimethyl-[4-methyl-3-(methylcarbamoyloxy)phenyl]azanium chloride, AMMONIUM, (3-HYDROXY-p-TOLYL)DIMETHYL(ETHOXYCARBONYLMETHYL)-, CHLORIDE, METHYLCA
| Molecular Formula | C15H23ClN2O4 |
|---|---|
| Molecular Weight | 330.13 g/mol |
| LogP | -1.15 |
| Topological Polar Surface Area | 64.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 330.13464 |
| Heavy Atoms | 22 |
| Complexity | 371.0 |
Chemical Identifiers
| CAS Number | 64049-96-3 |
|---|---|
| SMILES | CCOC(=O)C[N+](C)(C)C1=CC(=C(C=C1)C)OC(=O)NC.[Cl-] |
| InChIKey | YFCUVTOQZWNLTR-UHFFFAOYSA-N |
Product Overview
RefChem:318867 (CAS 64049-96-3), with molecular formula C15H23ClN2O4 and molecular weight 330.13 g/mol. IUPAC: (2-ethoxy-2-oxoethyl)-dimethyl-[4-methyl-3-(methylcarbamoyloxy)phenyl]azanium chloride.
Chemical Property Profile of RefChem:318867
Property Insights of RefChem:318867
The XLogP value of -1.15 indicates that RefChem:318867 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 64.6 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:318867. Following Lipinski's Rule of Five, RefChem:318867 has 1 hydrogen bond donor(s) and 5 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:318867?
The CAS number of RefChem:318867 is 64049-96-3.
What is the molecular formula of RefChem:318867?
The molecular formula of RefChem:318867 is C15H23ClN2O4.
What is the molecular weight of RefChem:318867?
The molecular weight of RefChem:318867 is 330.13 g/mol.
Where can I buy RefChem:318867?
You can request a quote for RefChem:318867 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:318867?
Yes, KEHONG BIO provides custom synthesis services for RefChem:318867 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.