4-Chloro-3,5-dimethylphenyl 2,3-dihydro-1,4-benzodioxine-2-carboxylate
TL;DR: 4-Chloro-3,5-dimethylphenyl 2,3-dihydro-1,4-benzodioxine-2-carboxylate (CAS 302574-82-9) is a chemical compound with molecular formula C17H15ClO4 and molecular weight 318.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-chloro-3,5-dimethylphenyl) 2,3-dihydro-1,4-benzodioxine-3-carboxylate
Also Known As: ChemDiv3_001355, IDI1_020321, 4-chloro-3,5-dimethylphenyl 2,3-dihydro-1,4-benzodioxine-2-carboxylate, BRD-A65483585-001-01-8, (4-chloro-3,5-dimethylphenyl) 2,3-dihydro-1,4-benzodioxine-3-carboxylate
| Molecular Formula | C17H15ClO4 |
|---|---|
| Molecular Weight | 318.07 g/mol |
| LogP | 3.70224 |
| Topological Polar Surface Area | 44.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 318.0659 |
| Heavy Atoms | 22 |
| Complexity | 703.34406 |
Chemical Identifiers
| CAS Number | 302574-82-9 |
|---|---|
| SMILES | CC1=CC(=CC(=C1Cl)C)OC(=O)C2COC3=CC=CC=C3O2 |
Product Overview
4-Chloro-3,5-dimethylphenyl 2,3-dihydro-1,4-benzodioxine-2-carboxylate (CAS 302574-82-9), with molecular formula C17H15ClO4 and molecular weight 318.07 g/mol. IUPAC: (4-chloro-3,5-dimethylphenyl) 2,3-dihydro-1,4-benzodioxine-3-carboxylate.
Chemical Property Profile of 4-Chloro-3,5-dimethylphenyl 2,3-dihydro-1,4-benzodioxine-2-carboxylate
Property Insights of 4-Chloro-3,5-dimethylphenyl 2,3-dihydro-1,4-benzodioxine-2-carboxylate
The XLogP value of 3.70224 indicates that 4-Chloro-3,5-dimethylphenyl 2,3-dihydro-1,4-benzodioxine-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.76 Ų, 4-Chloro-3,5-dimethylphenyl 2,3-dihydro-1,4-benzodioxine-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-3,5-dimethylphenyl 2,3-dihydro-1,4-benzodioxine-2-carboxylate has 0 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 4-Chloro-3,5-dimethylphenyl 2,3-dihydro-1,4-benzodioxine-2-carboxylate?
The CAS number of 4-Chloro-3,5-dimethylphenyl 2,3-dihydro-1,4-benzodioxine-2-carboxylate is 302574-82-9.
What is the molecular formula of 4-Chloro-3,5-dimethylphenyl 2,3-dihydro-1,4-benzodioxine-2-carboxylate?
The molecular formula of 4-Chloro-3,5-dimethylphenyl 2,3-dihydro-1,4-benzodioxine-2-carboxylate is C17H15ClO4.
What is the molecular weight of 4-Chloro-3,5-dimethylphenyl 2,3-dihydro-1,4-benzodioxine-2-carboxylate?
The molecular weight of 4-Chloro-3,5-dimethylphenyl 2,3-dihydro-1,4-benzodioxine-2-carboxylate is 318.07 g/mol.
Where can I buy 4-Chloro-3,5-dimethylphenyl 2,3-dihydro-1,4-benzodioxine-2-carboxylate?
You can request a quote for 4-Chloro-3,5-dimethylphenyl 2,3-dihydro-1,4-benzodioxine-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-3,5-dimethylphenyl 2,3-dihydro-1,4-benzodioxine-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-3,5-dimethylphenyl 2,3-dihydro-1,4-benzodioxine-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.