Cyclohexyl tetrachlorophthalate
TL;DR: Cyclohexyl tetrachlorophthalate (CAS 115841-75-3) is a chemical compound with molecular formula C14H12Cl4O4 and molecular weight 383.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,4,5-tetrachloro-6-cyclohexyloxycarbonylbenzoic acid
Also Known As: CYCLOHEXYL TETRACHLOROPHTHALATE, 2,3,4,5-tetrachloro-6-cyclohexyloxycarbonylbenzoic acid, 2,3,4,5-tetrachloro-6-cyclohexyloxycarbonyl-benzoic Acid, 2,3,4,5-tetrachloro-6-[(cyclohexyloxy)carbonyl]benzoic acid, 666-855-2
| Molecular Formula | C14H12Cl4O4 |
|---|---|
| Molecular Weight | 383.95 g/mol |
| LogP | 5.4879 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 383.94897 |
| Heavy Atoms | 22 |
| Complexity | 624.0042 |
Chemical Identifiers
| CAS Number | 115841-75-3 |
|---|---|
| SMILES | C1CCC(CC1)OC(=O)C2=C(C(=C(C(=C2Cl)Cl)Cl)Cl)C(=O)O |
Product Overview
Cyclohexyl tetrachlorophthalate (CAS 115841-75-3), with molecular formula C14H12Cl4O4 and molecular weight 383.95 g/mol. IUPAC: 2,3,4,5-tetrachloro-6-cyclohexyloxycarbonylbenzoic acid.
Chemical Property Profile of Cyclohexyl tetrachlorophthalate
Property Insights of Cyclohexyl tetrachlorophthalate
The XLogP value of 5.4879 indicates that Cyclohexyl tetrachlorophthalate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Cyclohexyl tetrachlorophthalate. Following Lipinski's Rule of Five, Cyclohexyl tetrachlorophthalate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cyclohexyl tetrachlorophthalate?
The CAS number of Cyclohexyl tetrachlorophthalate is 115841-75-3.
What is the molecular formula of Cyclohexyl tetrachlorophthalate?
The molecular formula of Cyclohexyl tetrachlorophthalate is C14H12Cl4O4.
What is the molecular weight of Cyclohexyl tetrachlorophthalate?
The molecular weight of Cyclohexyl tetrachlorophthalate is 383.95 g/mol.
Where can I buy Cyclohexyl tetrachlorophthalate?
You can request a quote for Cyclohexyl tetrachlorophthalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclohexyl tetrachlorophthalate?
Yes, KEHONG BIO provides custom synthesis services for Cyclohexyl tetrachlorophthalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.