2,2-双(4-氯苯氧基)乙酸
TL;DR: 2,2-双(4-氯苯氧基)乙酸 (CAS 29815-94-9) is a chemical compound with molecular formula C14H10Cl2O4 and molecular weight 312.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-双(4-氯苯氧基)乙酸
2,2-bis(4-chlorophenoxy)acetic acid
Also Known As: Refortan, Bis(4-chlorophenoxy)acetic acid, 2,2-bis(4-chlorophenoxy)acetic acid, Bis(p-chlorophenoxy)acetic acid, Acetic acid, bis(4-chlorophenoxy)-
| Molecular Formula | C14H10Cl2O4 |
|---|---|
| Molecular Weight | 312.00 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 311.9956 |
| Heavy Atoms | 20 |
| Complexity | 286.0 |
Chemical Identifiers
| CAS Number | 29815-94-9 |
|---|---|
| SMILES | C1=CC(=CC=C1OC(C(=O)O)OC2=CC=C(C=C2)Cl)Cl |
| InChIKey | ZKNSZZXBPSICFK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,2-双(4-氯苯氧基)乙酸 (CAS 29815-94-9), with molecular formula C14H10Cl2O4 and molecular weight 312.00 g/mol. IUPAC: 2,2-bis(4-chlorophenoxy)acetic acid.
Chemical Property Profile of 2,2-双(4-氯苯氧基)乙酸
Property Insights of 2,2-双(4-氯苯氧基)乙酸
The XLogP value of 4.5 indicates that 2,2-双(4-氯苯氧基)乙酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.8 Ų, 2,2-双(4-氯苯氧基)乙酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2-双(4-氯苯氧基)乙酸 has 1 hydrogen bond donor(s) and 4 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 2,2-双(4-氯苯氧基)乙酸?
The CAS number of 2,2-双(4-氯苯氧基)乙酸 is 29815-94-9.
What is the molecular formula of 2,2-双(4-氯苯氧基)乙酸?
The molecular formula of 2,2-双(4-氯苯氧基)乙酸 is C14H10Cl2O4.
What is the molecular weight of 2,2-双(4-氯苯氧基)乙酸?
The molecular weight of 2,2-双(4-氯苯氧基)乙酸 is 312.00 g/mol.
Where can I buy 2,2-双(4-氯苯氧基)乙酸?
You can request a quote for 2,2-双(4-氯苯氧基)乙酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-双(4-氯苯氧基)乙酸?
Yes, KEHONG BIO provides custom synthesis services for 2,2-双(4-氯苯氧基)乙酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.