2,4-Dichloro-5-isopropoxyanilinium chloride
TL;DR: 2,4-Dichloro-5-isopropoxyanilinium chloride (CAS 85554-76-3) is a chemical compound with molecular formula C9H12Cl3NO and molecular weight 255.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,4-dichloro-5-propan-2-yloxyphenyl)azanium chloride
Also Known As: 2,4-Dichloro-5-isopropoxyanilinium chloride, EINECS 287-609-7, 2,4-dichloro-5-isopropoxyaniliniumchloride, (2,4-dichloro-5-propan-2-yloxyphenyl)azanium chloride, (2,4-dichloro-5-propan-2-yloxyphenyl)azanium,chloride
| Molecular Formula | C9H12Cl3NO |
|---|---|
| Molecular Weight | 255.00 g/mol |
| LogP | -0.342 |
| Topological Polar Surface Area | 36.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 254.99844 |
| Heavy Atoms | 14 |
| Complexity | 315.17053 |
Chemical Identifiers
| CAS Number | 85554-76-3 |
|---|---|
| SMILES | CC(C)OC1=C(C=C(C(=C1)[NH3+])Cl)Cl.[Cl-] |
Product Overview
2,4-Dichloro-5-isopropoxyanilinium chloride (CAS 85554-76-3), with molecular formula C9H12Cl3NO and molecular weight 255.00 g/mol. IUPAC: (2,4-dichloro-5-propan-2-yloxyphenyl)azanium chloride.
Chemical Property Profile of 2,4-Dichloro-5-isopropoxyanilinium chloride
Property Insights of 2,4-Dichloro-5-isopropoxyanilinium chloride
The XLogP value of -0.342 indicates that 2,4-Dichloro-5-isopropoxyanilinium chloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 36.87 Ų, 2,4-Dichloro-5-isopropoxyanilinium chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Dichloro-5-isopropoxyanilinium chloride has 1 hydrogen bond donor(s) and 1 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 2,4-Dichloro-5-isopropoxyanilinium chloride?
The CAS number of 2,4-Dichloro-5-isopropoxyanilinium chloride is 85554-76-3.
What is the molecular formula of 2,4-Dichloro-5-isopropoxyanilinium chloride?
The molecular formula of 2,4-Dichloro-5-isopropoxyanilinium chloride is C9H12Cl3NO.
What is the molecular weight of 2,4-Dichloro-5-isopropoxyanilinium chloride?
The molecular weight of 2,4-Dichloro-5-isopropoxyanilinium chloride is 255.00 g/mol.
Where can I buy 2,4-Dichloro-5-isopropoxyanilinium chloride?
You can request a quote for 2,4-Dichloro-5-isopropoxyanilinium chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Dichloro-5-isopropoxyanilinium chloride?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Dichloro-5-isopropoxyanilinium chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.