Benzoic acid, 2,3,6-trichloro-4,5-dihydroxy-
TL;DR: Benzoic acid, 2,3,6-trichloro-4,5-dihydroxy- (CAS 99165-96-5) is a chemical compound with molecular formula C7H3Cl3O4 and molecular weight 255.9097 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,3,6-trichloro-4,5-dihydroxybenzoic acid
Also Known As: 2,3,6-trichloro-4,5-dihydroxybenzoic acid, Benzoic acid, 2,3,6-trichloro-4,5-dihydroxy-, TRICHLORO-3,4-DIHYDROXYBENZOIC ACID
Technical Specifications
| Molecular Formula | C7H3Cl3O4 |
| Molecular Weight | 255.9097 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 77.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 255.9097 Da |
| Heavy Atoms | 14 |
| Complexity | 237.0 |
| SMILES | C1(=C(C(=C(C(=C1Cl)Cl)O)O)Cl)C(=O)O |
| InChIKey | FAFLWTPCSJXFSP-UHFFFAOYSA-N |
Chemical Property Profile of Benzoic acid, 2,3,6-trichloro-4,5-dihydroxy-
Property Insights of Benzoic acid, 2,3,6-trichloro-4,5-dihydroxy-
The XLogP value of 3.2 indicates that Benzoic acid, 2,3,6-trichloro-4,5-dihydroxy- 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 Benzoic acid, 2,3,6-trichloro-4,5-dihydroxy-. Following Lipinski's Rule of Five, Benzoic acid, 2,3,6-trichloro-4,5-dihydroxy- 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
What is the CAS number of Benzoic acid, 2,3,6-trichloro-4,5-dihydroxy-?
The CAS number of Benzoic acid, 2,3,6-trichloro-4,5-dihydroxy- is 99165-96-5.
What is the molecular formula of Benzoic acid, 2,3,6-trichloro-4,5-dihydroxy-?
The molecular formula of Benzoic acid, 2,3,6-trichloro-4,5-dihydroxy- is C7H3Cl3O4.
What is the molecular weight of Benzoic acid, 2,3,6-trichloro-4,5-dihydroxy-?
The molecular weight of Benzoic acid, 2,3,6-trichloro-4,5-dihydroxy- is 255.9097 g/mol.
Where can I buy Benzoic acid, 2,3,6-trichloro-4,5-dihydroxy-?
You can request a quote for Benzoic acid, 2,3,6-trichloro-4,5-dihydroxy- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzoic acid, 2,3,6-trichloro-4,5-dihydroxy-?
Yes, CoreyChem provides custom synthesis services for Benzoic acid, 2,3,6-trichloro-4,5-dihydroxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.