Pentanedioic acid, mono(2-(dichloroamino)-2-methylpropyl) ester
TL;DR: Pentanedioic acid, mono(2-(dichloroamino)-2-methylpropyl) ester (CAS 82224-88-2) is a chemical compound with molecular formula C9H15Cl2NO4 and molecular weight 271.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[2-(dichloroamino)-2-methylpropoxy]-5-oxopentanoic acid
Also Known As: 5-[2-(dichloroamino)-2-methylpropoxy]-5-oxopentanoic acid, Mono(2-(dichloroamino)-2-methylpropyl) pentanedioate, Pentanedioic acid, mono(2-(dichloroamino)-2-methylpropyl) ester, RefChem:368135
| Molecular Formula | C9H15Cl2NO4 |
|---|---|
| Molecular Weight | 271.04 g/mol |
| LogP | -1.1 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 271.0378 |
| Heavy Atoms | 16 |
| Complexity | 256.0 |
Chemical Identifiers
| CAS Number | 82224-88-2 |
|---|---|
| SMILES | CC(C)(COC(=O)CCCC(=O)O)N(Cl)Cl |
| InChIKey | UVZCJDALSYJEOG-UHFFFAOYSA-N |
Product Overview
Pentanedioic acid, mono(2-(dichloroamino)-2-methylpropyl) ester (CAS 82224-88-2), with molecular formula C9H15Cl2NO4 and molecular weight 271.04 g/mol. IUPAC: 5-[2-(dichloroamino)-2-methylpropoxy]-5-oxopentanoic acid.
Chemical Property Profile of Pentanedioic acid, mono(2-(dichloroamino)-2-methylpropyl) ester
Property Insights of Pentanedioic acid, mono(2-(dichloroamino)-2-methylpropyl) ester
The XLogP value of -1.1 indicates that Pentanedioic acid, mono(2-(dichloroamino)-2-methylpropyl) ester is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Pentanedioic acid, mono(2-(dichloroamino)-2-methylpropyl) ester. Following Lipinski's Rule of Five, Pentanedioic acid, mono(2-(dichloroamino)-2-methylpropyl) ester 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 Pentanedioic acid, mono(2-(dichloroamino)-2-methylpropyl) ester?
The CAS number of Pentanedioic acid, mono(2-(dichloroamino)-2-methylpropyl) ester is 82224-88-2.
What is the molecular formula of Pentanedioic acid, mono(2-(dichloroamino)-2-methylpropyl) ester?
The molecular formula of Pentanedioic acid, mono(2-(dichloroamino)-2-methylpropyl) ester is C9H15Cl2NO4.
What is the molecular weight of Pentanedioic acid, mono(2-(dichloroamino)-2-methylpropyl) ester?
The molecular weight of Pentanedioic acid, mono(2-(dichloroamino)-2-methylpropyl) ester is 271.04 g/mol.
Where can I buy Pentanedioic acid, mono(2-(dichloroamino)-2-methylpropyl) ester?
You can request a quote for Pentanedioic acid, mono(2-(dichloroamino)-2-methylpropyl) ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pentanedioic acid, mono(2-(dichloroamino)-2-methylpropyl) ester?
Yes, KEHONG BIO provides custom synthesis services for Pentanedioic acid, mono(2-(dichloroamino)-2-methylpropyl) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.