Dimethylammonium 2-(4-chlorophenoxy)-2-methylpropionate
TL;DR: Dimethylammonium 2-(4-chlorophenoxy)-2-methylpropionate (CAS 60508-74-9) is a chemical compound with molecular formula C12H18ClNO3 and molecular weight 259.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenoxy)-2-methylpropanoic acid;N-methylmethanamine
Also Known As: EINECS 262-272-9, dimethylammonium2-2-methylpropionate, Dimethylammonium 2-(4-chlorophenoxy)-2-methylpropionate, Nonanoic acid,[1,1'-biphenyl]-4-yl ester, dimethylammonium 2-(4-chlorophenoxy)-2-methylpropanoate
| Molecular Formula | C12H18ClNO3 |
|---|---|
| Molecular Weight | 259.10 g/mol |
| LogP | 2.4176 |
| Topological Polar Surface Area | 58.56 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 259.09753 |
| Heavy Atoms | 17 |
| Complexity | 349.27332 |
Chemical Identifiers
| CAS Number | 60508-74-9 |
|---|---|
| SMILES | CC(C)(C(=O)O)OC1=CC=C(C=C1)Cl.CNC |
Product Overview
Dimethylammonium 2-(4-chlorophenoxy)-2-methylpropionate (CAS 60508-74-9), with molecular formula C12H18ClNO3 and molecular weight 259.10 g/mol. IUPAC: 2-(4-chlorophenoxy)-2-methylpropanoic acid;N-methylmethanamine.
Chemical Property Profile of Dimethylammonium 2-(4-chlorophenoxy)-2-methylpropionate
Property Insights of Dimethylammonium 2-(4-chlorophenoxy)-2-methylpropionate
The XLogP value of 2.4176 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethylammonium 2-(4-chlorophenoxy)-2-methylpropionate. With a topological polar surface area (TPSA) of 58.56 Ų, Dimethylammonium 2-(4-chlorophenoxy)-2-methylpropionate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dimethylammonium 2-(4-chlorophenoxy)-2-methylpropionate 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 Dimethylammonium 2-(4-chlorophenoxy)-2-methylpropionate?
The CAS number of Dimethylammonium 2-(4-chlorophenoxy)-2-methylpropionate is 60508-74-9.
What is the molecular formula of Dimethylammonium 2-(4-chlorophenoxy)-2-methylpropionate?
The molecular formula of Dimethylammonium 2-(4-chlorophenoxy)-2-methylpropionate is C12H18ClNO3.
What is the molecular weight of Dimethylammonium 2-(4-chlorophenoxy)-2-methylpropionate?
The molecular weight of Dimethylammonium 2-(4-chlorophenoxy)-2-methylpropionate is 259.10 g/mol.
Where can I buy Dimethylammonium 2-(4-chlorophenoxy)-2-methylpropionate?
You can request a quote for Dimethylammonium 2-(4-chlorophenoxy)-2-methylpropionate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethylammonium 2-(4-chlorophenoxy)-2-methylpropionate?
Yes, KEHONG BIO provides custom synthesis services for Dimethylammonium 2-(4-chlorophenoxy)-2-methylpropionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.