Dimethyl 4-aminophthalate
TL;DR: Dimethyl 4-aminophthalate (CAS 51832-31-6) is a chemical compound with molecular formula C10H11NO4 and molecular weight 209.0688 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dimethyl 4-aminobenzene-1,2-dicarboxylate
Also Known As: Dimethyl 4-aminophthalate, 1,2-Dimethyl 4-aminophthalate, dimethyl4-aminophthalate, 4-aminophthalic acid dimethyl ester, dimethyl 4-aminobenzene-1,2-dicarboxylate
Application Areas
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H11NO4 |
| Molecular Weight | 209.0688 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 78.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 209.0688 Da |
| Heavy Atoms | 15 |
| Complexity | 254.0 |
| SMILES | COC(=O)C1=C(C=C(C=C1)N)C(=O)OC |
| InChIKey | NTBHQNDXAJXRPU-UHFFFAOYSA-N |
Chemical Property Profile of Dimethyl 4-aminophthalate
Property Insights of Dimethyl 4-aminophthalate
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl 4-aminophthalate. The TPSA of 78.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 4-aminophthalate. Following Lipinski's Rule of Five, Dimethyl 4-aminophthalate 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
What is the CAS number of Dimethyl 4-aminophthalate?
The CAS number of Dimethyl 4-aminophthalate is 51832-31-6.
What is the molecular formula of Dimethyl 4-aminophthalate?
The molecular formula of Dimethyl 4-aminophthalate is C10H11NO4.
What is the molecular weight of Dimethyl 4-aminophthalate?
The molecular weight of Dimethyl 4-aminophthalate is 209.0688 g/mol.
Where can I buy Dimethyl 4-aminophthalate?
You can request a quote for Dimethyl 4-aminophthalate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Dimethyl 4-aminophthalate?
Yes, CoreyChem provides custom synthesis services for Dimethyl 4-aminophthalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.