3,5-Dichloro-2,4-dihydroxy-6-pentylbenzoic acid
TL;DR: 3,5-Dichloro-2,4-dihydroxy-6-pentylbenzoic acid (CAS 64185-27-9) is a chemical compound with molecular formula C12H14Cl2O4 and molecular weight 292.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dichloro-2,4-dihydroxy-6-pentylbenzoic acid
Also Known As: 3,5-Dichloro-2,4-dihydroxy-6-pentylbenzoic acid, 3,5-Dichloro-2,4-dihydroxy-6-pentylbenzoicacid, Benzoic acid, 3,5-dichloro-2,4-dihydroxy-6-pentyl-, 3,5-Dichloro-2,4-dihydroxy-6-pentylbenzoic acid #
| Molecular Formula | C12H14Cl2O4 |
|---|---|
| Molecular Weight | 292.03 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 77.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 292.02692 |
| Heavy Atoms | 18 |
| Complexity | 287.0 |
Chemical Identifiers
| CAS Number | 64185-27-9 |
|---|---|
| SMILES | CCCCCC1=C(C(=C(C(=C1Cl)O)Cl)O)C(=O)O |
| InChIKey | NFASENGEDPDADX-UHFFFAOYSA-N |
Product Overview
3,5-Dichloro-2,4-dihydroxy-6-pentylbenzoic acid (CAS 64185-27-9), with molecular formula C12H14Cl2O4 and molecular weight 292.03 g/mol. IUPAC: 3,5-dichloro-2,4-dihydroxy-6-pentylbenzoic acid.
Chemical Property Profile of 3,5-Dichloro-2,4-dihydroxy-6-pentylbenzoic acid
Property Insights of 3,5-Dichloro-2,4-dihydroxy-6-pentylbenzoic acid
The XLogP value of 5.0 indicates that 3,5-Dichloro-2,4-dihydroxy-6-pentylbenzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5-Dichloro-2,4-dihydroxy-6-pentylbenzoic acid. Following Lipinski's Rule of Five, 3,5-Dichloro-2,4-dihydroxy-6-pentylbenzoic acid has 3 hydrogen bond donor(s) and 4 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 3,5-Dichloro-2,4-dihydroxy-6-pentylbenzoic acid?
The CAS number of 3,5-Dichloro-2,4-dihydroxy-6-pentylbenzoic acid is 64185-27-9.
What is the molecular formula of 3,5-Dichloro-2,4-dihydroxy-6-pentylbenzoic acid?
The molecular formula of 3,5-Dichloro-2,4-dihydroxy-6-pentylbenzoic acid is C12H14Cl2O4.
What is the molecular weight of 3,5-Dichloro-2,4-dihydroxy-6-pentylbenzoic acid?
The molecular weight of 3,5-Dichloro-2,4-dihydroxy-6-pentylbenzoic acid is 292.03 g/mol.
Where can I buy 3,5-Dichloro-2,4-dihydroxy-6-pentylbenzoic acid?
You can request a quote for 3,5-Dichloro-2,4-dihydroxy-6-pentylbenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Dichloro-2,4-dihydroxy-6-pentylbenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Dichloro-2,4-dihydroxy-6-pentylbenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.