Irx 1767
TL;DR: Irx 1767 (CAS 82224-85-9) is a chemical compound with molecular formula C5H9Cl2NO2 and molecular weight 185.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(dichloroamino)-3-methylbutanoic acid
Also Known As: Chloramine acid, 3-(Dichloroamino)-3-methylbutanoic acid, Irx 1767, 3- -3-methyl-butanoicacid, BUTANOIC ACID, 3-(DICHLOROAMINO)-3-METHYL-
| Molecular Formula | C5H9Cl2NO2 |
|---|---|
| Molecular Weight | 185.00 g/mol |
| LogP | -1.3 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 185.00104 |
| Heavy Atoms | 10 |
| Complexity | 136.0 |
Chemical Identifiers
| CAS Number | 82224-85-9 |
|---|---|
| SMILES | CC(C)(CC(=O)O)N(Cl)Cl |
| InChIKey | DOROJKAARCRGPI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Irx 1767 (CAS 82224-85-9), with molecular formula C5H9Cl2NO2 and molecular weight 185.00 g/mol. IUPAC: 3-(dichloroamino)-3-methylbutanoic acid.
Chemical Property Profile of Irx 1767
Property Insights of Irx 1767
The XLogP value of -1.3 indicates that Irx 1767 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 40.5 Ų, Irx 1767 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Irx 1767 has 1 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 Irx 1767?
The CAS number of Irx 1767 is 82224-85-9.
What is the molecular formula of Irx 1767?
The molecular formula of Irx 1767 is C5H9Cl2NO2.
What is the molecular weight of Irx 1767?
The molecular weight of Irx 1767 is 185.00 g/mol.
Where can I buy Irx 1767?
You can request a quote for Irx 1767 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Irx 1767?
Yes, KEHONG BIO provides custom synthesis services for Irx 1767 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.