Decyl 1,3-dioxo-1,3-dihydro-2-benzofuran-5-carboxylate
TL;DR: Decyl 1,3-dioxo-1,3-dihydro-2-benzofuran-5-carboxylate (CAS 33975-31-4) is a chemical compound with molecular formula C19H24O5 and molecular weight 332.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
decyl 1,3-dioxo-2-benzofuran-5-carboxylate
Also Known As: Decyl 1,3-dioxo-1,3-dihydro-2-benzofuran-5-carboxylate, decyl 1,3-dioxo-2-benzofuran-5-carboxylate, 1,3-Dioxoisobenzofuran-5-carboxylic acid decyl ester, 1,2,4-Benzenetricarboxylic acid, cyclic 1,2-anhydride, decyl ester, Decyl 1,3-dioxo-1,3-dihydro-2-benzofuran-5-carboxylate #
| Molecular Formula | C19H24O5 |
|---|---|
| Molecular Weight | 332.16 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 69.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 332.16238 |
| Heavy Atoms | 24 |
| Complexity | 445.0 |
Chemical Identifiers
| CAS Number | 33975-31-4 |
|---|---|
| SMILES | CCCCCCCCCCOC(=O)C1=CC2=C(C=C1)C(=O)OC2=O |
| InChIKey | BMHRRTHNGNXZRJ-UHFFFAOYSA-N |
Product Overview
Decyl 1,3-dioxo-1,3-dihydro-2-benzofuran-5-carboxylate (CAS 33975-31-4), with molecular formula C19H24O5 and molecular weight 332.16 g/mol. IUPAC: decyl 1,3-dioxo-2-benzofuran-5-carboxylate.
Chemical Property Profile of Decyl 1,3-dioxo-1,3-dihydro-2-benzofuran-5-carboxylate
Property Insights of Decyl 1,3-dioxo-1,3-dihydro-2-benzofuran-5-carboxylate
The XLogP value of 5.6 indicates that Decyl 1,3-dioxo-1,3-dihydro-2-benzofuran-5-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Decyl 1,3-dioxo-1,3-dihydro-2-benzofuran-5-carboxylate. Following Lipinski's Rule of Five, Decyl 1,3-dioxo-1,3-dihydro-2-benzofuran-5-carboxylate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Decyl 1,3-dioxo-1,3-dihydro-2-benzofuran-5-carboxylate?
The CAS number of Decyl 1,3-dioxo-1,3-dihydro-2-benzofuran-5-carboxylate is 33975-31-4.
What is the molecular formula of Decyl 1,3-dioxo-1,3-dihydro-2-benzofuran-5-carboxylate?
The molecular formula of Decyl 1,3-dioxo-1,3-dihydro-2-benzofuran-5-carboxylate is C19H24O5.
What is the molecular weight of Decyl 1,3-dioxo-1,3-dihydro-2-benzofuran-5-carboxylate?
The molecular weight of Decyl 1,3-dioxo-1,3-dihydro-2-benzofuran-5-carboxylate is 332.16 g/mol.
Where can I buy Decyl 1,3-dioxo-1,3-dihydro-2-benzofuran-5-carboxylate?
You can request a quote for Decyl 1,3-dioxo-1,3-dihydro-2-benzofuran-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Decyl 1,3-dioxo-1,3-dihydro-2-benzofuran-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Decyl 1,3-dioxo-1,3-dihydro-2-benzofuran-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.