5-Methyl-2,3-dihydro-1,4-benzodioxine-3-carboxylic acid
TL;DR: 5-Methyl-2,3-dihydro-1,4-benzodioxine-3-carboxylic acid (CAS 70970-73-9) is a chemical compound with molecular formula C10H10O4 and molecular weight 194.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-2,3-dihydro-1,4-benzodioxine-3-carboxylic acid
Also Known As: 1,4-Benzodioxin-2-carboxylic acid, 2,3-dihydro-8-methyl-, 5-methyl-2,3-dihydro-1,4-benzodioxine-3-carboxylic acid, 2-methyl-7,10-dioxabicyclo[4.4.0]deca-1,3,5-triene-9-carboxylic Acid
| Molecular Formula | C10H10O4 |
|---|---|
| Molecular Weight | 194.06 g/mol |
| LogP | 1.21942 |
| Topological Polar Surface Area | 55.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 194.0579 |
| Heavy Atoms | 14 |
| Complexity | 372.3848 |
Chemical Identifiers
| CAS Number | 70970-73-9 |
|---|---|
| SMILES | CC1=C2C(=CC=C1)OCC(O2)C(=O)O |
Product Overview
5-Methyl-2,3-dihydro-1,4-benzodioxine-3-carboxylic acid (CAS 70970-73-9), with molecular formula C10H10O4 and molecular weight 194.06 g/mol. IUPAC: 5-methyl-2,3-dihydro-1,4-benzodioxine-3-carboxylic acid.
Chemical Property Profile of 5-Methyl-2,3-dihydro-1,4-benzodioxine-3-carboxylic acid
Property Insights of 5-Methyl-2,3-dihydro-1,4-benzodioxine-3-carboxylic acid
The XLogP value of 1.21942 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Methyl-2,3-dihydro-1,4-benzodioxine-3-carboxylic acid. With a topological polar surface area (TPSA) of 55.76 Ų, 5-Methyl-2,3-dihydro-1,4-benzodioxine-3-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Methyl-2,3-dihydro-1,4-benzodioxine-3-carboxylic acid 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 5-Methyl-2,3-dihydro-1,4-benzodioxine-3-carboxylic acid?
The CAS number of 5-Methyl-2,3-dihydro-1,4-benzodioxine-3-carboxylic acid is 70970-73-9.
What is the molecular formula of 5-Methyl-2,3-dihydro-1,4-benzodioxine-3-carboxylic acid?
The molecular formula of 5-Methyl-2,3-dihydro-1,4-benzodioxine-3-carboxylic acid is C10H10O4.
What is the molecular weight of 5-Methyl-2,3-dihydro-1,4-benzodioxine-3-carboxylic acid?
The molecular weight of 5-Methyl-2,3-dihydro-1,4-benzodioxine-3-carboxylic acid is 194.06 g/mol.
Where can I buy 5-Methyl-2,3-dihydro-1,4-benzodioxine-3-carboxylic acid?
You can request a quote for 5-Methyl-2,3-dihydro-1,4-benzodioxine-3-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Methyl-2,3-dihydro-1,4-benzodioxine-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Methyl-2,3-dihydro-1,4-benzodioxine-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.