4-Aminobenzene-1,2-diyl diacetate
TL;DR: 4-Aminobenzene-1,2-diyl diacetate (CAS 71573-24-5) is a chemical compound with molecular formula C10H11NO4 and molecular weight 209.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-acetyloxy-4-aminophenyl) acetate
Also Known As: 4-aminobenzene-1,2-diyl diacetate, (2-acetyloxy-4-aminophenyl) acetate, 4-Amino-1,2-phenylene diacetate, 4-amino-1,2-benzenediol diacetate, 1,2-Benzenediol,4-amino-, 1,2-diacetate
| Molecular Formula | C10H11NO4 |
|---|---|
| Molecular Weight | 209.07 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 78.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 209.0688 |
| Heavy Atoms | 15 |
| Complexity | 254.0 |
Chemical Identifiers
| CAS Number | 71573-24-5 |
|---|---|
| SMILES | CC(=O)OC1=C(C=C(C=C1)N)OC(=O)C |
| InChIKey | JPBLUIHWOVGRCD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Aminobenzene-1,2-diyl diacetate (CAS 71573-24-5), with molecular formula C10H11NO4 and molecular weight 209.07 g/mol. IUPAC: (2-acetyloxy-4-aminophenyl) acetate.
Chemical Property Profile of 4-Aminobenzene-1,2-diyl diacetate
Property Insights of 4-Aminobenzene-1,2-diyl diacetate
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Aminobenzene-1,2-diyl diacetate. The TPSA of 78.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Aminobenzene-1,2-diyl diacetate. Following Lipinski's Rule of Five, 4-Aminobenzene-1,2-diyl diacetate 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 4-Aminobenzene-1,2-diyl diacetate?
The CAS number of 4-Aminobenzene-1,2-diyl diacetate is 71573-24-5.
What is the molecular formula of 4-Aminobenzene-1,2-diyl diacetate?
The molecular formula of 4-Aminobenzene-1,2-diyl diacetate is C10H11NO4.
What is the molecular weight of 4-Aminobenzene-1,2-diyl diacetate?
The molecular weight of 4-Aminobenzene-1,2-diyl diacetate is 209.07 g/mol.
Where can I buy 4-Aminobenzene-1,2-diyl diacetate?
You can request a quote for 4-Aminobenzene-1,2-diyl diacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Aminobenzene-1,2-diyl diacetate?
Yes, KEHONG BIO provides custom synthesis services for 4-Aminobenzene-1,2-diyl diacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.