3,5-二氯苯甲酸
TL;DR: 3,5-二氯苯甲酸 (CAS 51-36-5) is a chemical compound with molecular formula C7H4Cl2O2 and molecular weight 189.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-二氯苯甲酸
3,5-dichlorobenzoic acid
Also Known As: 3,5-DICHLOROBENZOIC ACID, Benzoic acid, 3,5-dichloro-, Diobutil, 3,5-Dichloro-benzoic acid, Propyzamide metabolite
| Molecular Formula | C7H4Cl2O2 |
|---|---|
| Molecular Weight | 189.96 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 189.95883 |
| Heavy Atoms | 11 |
| Complexity | 151.0 |
Chemical Identifiers
| CAS Number | 51-36-5 |
|---|---|
| SMILES | C1=C(C=C(C=C1Cl)Cl)C(=O)O |
| InChIKey | CXKCZFDUOYMOOP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,5-二氯苯甲酸 (CAS 51-36-5), with molecular formula C7H4Cl2O2 and molecular weight 189.96 g/mol. IUPAC: 3,5-dichlorobenzoic acid.
Chemical Property Profile of 3,5-二氯苯甲酸
Property Insights of 3,5-二氯苯甲酸
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5-二氯苯甲酸. With a topological polar surface area (TPSA) of 37.3 Ų, 3,5-二氯苯甲酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-二氯苯甲酸 has 1 hydrogen bond donor(s) and 2 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 3,5-二氯苯甲酸?
The CAS number of 3,5-二氯苯甲酸 is 51-36-5.
What is the molecular formula of 3,5-二氯苯甲酸?
The molecular formula of 3,5-二氯苯甲酸 is C7H4Cl2O2.
What is the molecular weight of 3,5-二氯苯甲酸?
The molecular weight of 3,5-二氯苯甲酸 is 189.96 g/mol.
Where can I buy 3,5-二氯苯甲酸?
You can request a quote for 3,5-二氯苯甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-二氯苯甲酸?
Yes, KEHONG BIO provides custom synthesis services for 3,5-二氯苯甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.