(2,3,4,5,6-Pentachlorophenyl) 2-aminoacetate
TL;DR: (2,3,4,5,6-Pentachlorophenyl) 2-aminoacetate (CAS 21313-35-9) is a chemical compound with molecular formula C8H4Cl5NO2 and molecular weight 320.87 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,3,4,5,6-pentachlorophenyl) 2-aminoacetate
Also Known As: (2,3,4,5,6-pentachlorophenyl) 2-aminoacetate
| Molecular Formula | C8H4Cl5NO2 |
|---|---|
| Molecular Weight | 320.87 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 320.86847 |
| Heavy Atoms | 16 |
| Complexity | 251.0 |
Chemical Identifiers
| CAS Number | 21313-35-9 |
|---|---|
| SMILES | C(C(=O)OC1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)N |
| InChIKey | WCOJQKOAFOCPQO-UHFFFAOYSA-N |
Product Overview
(2,3,4,5,6-Pentachlorophenyl) 2-aminoacetate (CAS 21313-35-9), with molecular formula C8H4Cl5NO2 and molecular weight 320.87 g/mol. IUPAC: (2,3,4,5,6-pentachlorophenyl) 2-aminoacetate.
Chemical Property Profile of (2,3,4,5,6-Pentachlorophenyl) 2-aminoacetate
Property Insights of (2,3,4,5,6-Pentachlorophenyl) 2-aminoacetate
The XLogP value of 3.9 indicates that (2,3,4,5,6-Pentachlorophenyl) 2-aminoacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.3 Ų, (2,3,4,5,6-Pentachlorophenyl) 2-aminoacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2,3,4,5,6-Pentachlorophenyl) 2-aminoacetate has 1 hydrogen bond donor(s) and 3 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 (2,3,4,5,6-Pentachlorophenyl) 2-aminoacetate?
The CAS number of (2,3,4,5,6-Pentachlorophenyl) 2-aminoacetate is 21313-35-9.
What is the molecular formula of (2,3,4,5,6-Pentachlorophenyl) 2-aminoacetate?
The molecular formula of (2,3,4,5,6-Pentachlorophenyl) 2-aminoacetate is C8H4Cl5NO2.
What is the molecular weight of (2,3,4,5,6-Pentachlorophenyl) 2-aminoacetate?
The molecular weight of (2,3,4,5,6-Pentachlorophenyl) 2-aminoacetate is 320.87 g/mol.
Where can I buy (2,3,4,5,6-Pentachlorophenyl) 2-aminoacetate?
You can request a quote for (2,3,4,5,6-Pentachlorophenyl) 2-aminoacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2,3,4,5,6-Pentachlorophenyl) 2-aminoacetate?
Yes, KEHONG BIO provides custom synthesis services for (2,3,4,5,6-Pentachlorophenyl) 2-aminoacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.