7-Amino-2,3-dihydro-1,4-benzodioxine-6-carboxylic acid
TL;DR: 7-Amino-2,3-dihydro-1,4-benzodioxine-6-carboxylic acid (CAS 99358-09-5) is a chemical compound with molecular formula C9H9NO4 and molecular weight 195.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-2,3-dihydro-1,4-benzodioxine-7-carboxylic acid
Also Known As: 7-amino-2,3-dihydro-1,4-benzodioxine-6-carboxylic acid, 7-Amino-2,3-dihydrobenzo[b][1,4]dioxine-6-carboxylic acid, 7-Amino-2,3-dihydro-benzo[1,4]dioxine-6-carboxylic acid, 3644AJ, BAS 03213147
| Molecular Formula | C9H9NO4 |
|---|---|
| Molecular Weight | 195.05 g/mol |
| LogP | 0.7382 |
| Topological Polar Surface Area | 81.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 195.05316 |
| Heavy Atoms | 14 |
| Complexity | 388.6435 |
Chemical Identifiers
| CAS Number | 99358-09-5 |
|---|---|
| SMILES | C1COC2=C(O1)C=C(C(=C2)N)C(=O)O |
Product Overview
7-Amino-2,3-dihydro-1,4-benzodioxine-6-carboxylic acid (CAS 99358-09-5), with molecular formula C9H9NO4 and molecular weight 195.05 g/mol. IUPAC: 6-amino-2,3-dihydro-1,4-benzodioxine-7-carboxylic acid.
Chemical Property Profile of 7-Amino-2,3-dihydro-1,4-benzodioxine-6-carboxylic acid
Property Insights of 7-Amino-2,3-dihydro-1,4-benzodioxine-6-carboxylic acid
The XLogP value of 0.7382 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Amino-2,3-dihydro-1,4-benzodioxine-6-carboxylic acid. The TPSA of 81.78 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-Amino-2,3-dihydro-1,4-benzodioxine-6-carboxylic acid. Following Lipinski's Rule of Five, 7-Amino-2,3-dihydro-1,4-benzodioxine-6-carboxylic acid has 2 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 7-Amino-2,3-dihydro-1,4-benzodioxine-6-carboxylic acid?
The CAS number of 7-Amino-2,3-dihydro-1,4-benzodioxine-6-carboxylic acid is 99358-09-5.
What is the molecular formula of 7-Amino-2,3-dihydro-1,4-benzodioxine-6-carboxylic acid?
The molecular formula of 7-Amino-2,3-dihydro-1,4-benzodioxine-6-carboxylic acid is C9H9NO4.
What is the molecular weight of 7-Amino-2,3-dihydro-1,4-benzodioxine-6-carboxylic acid?
The molecular weight of 7-Amino-2,3-dihydro-1,4-benzodioxine-6-carboxylic acid is 195.05 g/mol.
Where can I buy 7-Amino-2,3-dihydro-1,4-benzodioxine-6-carboxylic acid?
You can request a quote for 7-Amino-2,3-dihydro-1,4-benzodioxine-6-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Amino-2,3-dihydro-1,4-benzodioxine-6-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 7-Amino-2,3-dihydro-1,4-benzodioxine-6-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.