3,4-Dichlorobenzoic anhydride
TL;DR: 3,4-Dichlorobenzoic anhydride (CAS 86866-14-0) is a chemical compound with molecular formula C14H6Cl4O3 and molecular weight 361.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,4-dichlorobenzoyl) 3,4-dichlorobenzoate
Also Known As: 3,4-Dichlorobenzoic anhydride, 3,4-Dichlorobenzoicanhydride, (3,4-dichlorobenzoyl) 3,4-dichlorobenzoate, 3,4-Dichlorophenyl anhydride, 3,4-Dichlorobenzoic acid anhydride
| Molecular Formula | C14H6Cl4O3 |
|---|---|
| Molecular Weight | 361.91 g/mol |
| LogP | 5.7 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 361.9071 |
| Heavy Atoms | 21 |
| Complexity | 368.0 |
Chemical Identifiers
| CAS Number | 86866-14-0 |
|---|---|
| SMILES | C1=CC(=C(C=C1C(=O)OC(=O)C2=CC(=C(C=C2)Cl)Cl)Cl)Cl |
| InChIKey | JKRVKAAJSJWYFT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,4-Dichlorobenzoic anhydride (CAS 86866-14-0), with molecular formula C14H6Cl4O3 and molecular weight 361.91 g/mol. IUPAC: (3,4-dichlorobenzoyl) 3,4-dichlorobenzoate.
Chemical Property Profile of 3,4-Dichlorobenzoic anhydride
Property Insights of 3,4-Dichlorobenzoic anhydride
The XLogP value of 5.7 indicates that 3,4-Dichlorobenzoic anhydride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.4 Ų, 3,4-Dichlorobenzoic anhydride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Dichlorobenzoic anhydride has 0 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 3,4-Dichlorobenzoic anhydride?
The CAS number of 3,4-Dichlorobenzoic anhydride is 86866-14-0.
What is the molecular formula of 3,4-Dichlorobenzoic anhydride?
The molecular formula of 3,4-Dichlorobenzoic anhydride is C14H6Cl4O3.
What is the molecular weight of 3,4-Dichlorobenzoic anhydride?
The molecular weight of 3,4-Dichlorobenzoic anhydride is 361.91 g/mol.
Where can I buy 3,4-Dichlorobenzoic anhydride?
You can request a quote for 3,4-Dichlorobenzoic anhydride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Dichlorobenzoic anhydride?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Dichlorobenzoic anhydride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.