Acetic acid, (2,3-dichloro-4-(2-furoyl)phenoxy)-
TL;DR: Acetic acid, (2,3-dichloro-4-(2-furoyl)phenoxy)- (CAS 55901-72-9) is a chemical compound with molecular formula C13H8Cl2O5 and molecular weight 313.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2,3-dichloro-4-(furan-2-carbonyl)phenoxy]acetic acid
Also Known As: 2,3-Dichloro-4- phenoxyaceticacid, (2,3-Dichloro-4-(2-furoyl)phenoxy)acetic acid, 4-(2-Furylketo)-2,3-dichlorophenoxyacetic acid, ACETIC ACID, (2,3-DICHLORO-4-(2-FUROYL)PHENOXY)-, 5-18-02-00006 (Beilstein Handbook Reference)
| Molecular Formula | C13H8Cl2O5 |
|---|---|
| Molecular Weight | 313.97 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 76.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 313.97488 |
| Heavy Atoms | 20 |
| Complexity | 376.0 |
Chemical Identifiers
| CAS Number | 55901-72-9 |
|---|---|
| SMILES | C1=COC(=C1)C(=O)C2=C(C(=C(C=C2)OCC(=O)O)Cl)Cl |
| InChIKey | ICGCGLGUMNPSPQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Acetic acid, (2,3-dichloro-4-(2-furoyl)phenoxy)- (CAS 55901-72-9), with molecular formula C13H8Cl2O5 and molecular weight 313.97 g/mol. IUPAC: 2-[2,3-dichloro-4-(furan-2-carbonyl)phenoxy]acetic acid.
Chemical Property Profile of Acetic acid, (2,3-dichloro-4-(2-furoyl)phenoxy)-
Property Insights of Acetic acid, (2,3-dichloro-4-(2-furoyl)phenoxy)-
The XLogP value of 3.5 indicates that Acetic acid, (2,3-dichloro-4-(2-furoyl)phenoxy)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetic acid, (2,3-dichloro-4-(2-furoyl)phenoxy)-. Following Lipinski's Rule of Five, Acetic acid, (2,3-dichloro-4-(2-furoyl)phenoxy)- has 1 hydrogen bond donor(s) and 5 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 Acetic acid, (2,3-dichloro-4-(2-furoyl)phenoxy)-?
The CAS number of Acetic acid, (2,3-dichloro-4-(2-furoyl)phenoxy)- is 55901-72-9.
What is the molecular formula of Acetic acid, (2,3-dichloro-4-(2-furoyl)phenoxy)-?
The molecular formula of Acetic acid, (2,3-dichloro-4-(2-furoyl)phenoxy)- is C13H8Cl2O5.
What is the molecular weight of Acetic acid, (2,3-dichloro-4-(2-furoyl)phenoxy)-?
The molecular weight of Acetic acid, (2,3-dichloro-4-(2-furoyl)phenoxy)- is 313.97 g/mol.
Where can I buy Acetic acid, (2,3-dichloro-4-(2-furoyl)phenoxy)-?
You can request a quote for Acetic acid, (2,3-dichloro-4-(2-furoyl)phenoxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid, (2,3-dichloro-4-(2-furoyl)phenoxy)-?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, (2,3-dichloro-4-(2-furoyl)phenoxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.