Benzyl 2-oxo-8-prop-2-enyl-chromene-3-carboxylate
TL;DR: Benzyl 2-oxo-8-prop-2-enyl-chromene-3-carboxylate (CAS 5532-49-0) is a chemical compound with molecular formula C20H16O4 and molecular weight 320.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl 2-oxo-8-prop-2-enylchromene-3-carboxylate
Also Known As: BENZYL 2-OXO-8-PROP-2-ENYL-CHROMENE-3-CARBOXYLATE, BIM-0006339.P001, benzyl 2-oxo-8-prop-2-enylchromene-3-carboxylate, benzyl 8-allyl-2-oxo-2H-chromene-3-carboxylate, Benzyl 2-oxo-8-(prop-2-en-1-yl)-2H-1-benzopyran-3-carboxylate
| Molecular Formula | C20H16O4 |
|---|---|
| Molecular Weight | 320.10 g/mol |
| LogP | 3.8785 |
| Topological Polar Surface Area | 56.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 320.10486 |
| Heavy Atoms | 24 |
| Complexity | 938.76013 |
Chemical Identifiers
| CAS Number | 5532-49-0 |
|---|---|
| SMILES | C=CCC1=CC=CC2=C1OC(=O)C(=C2)C(=O)OCC3=CC=CC=C3 |
Product Overview
Benzyl 2-oxo-8-prop-2-enyl-chromene-3-carboxylate (CAS 5532-49-0), with molecular formula C20H16O4 and molecular weight 320.10 g/mol. IUPAC: benzyl 2-oxo-8-prop-2-enylchromene-3-carboxylate.
Chemical Property Profile of Benzyl 2-oxo-8-prop-2-enyl-chromene-3-carboxylate
Property Insights of Benzyl 2-oxo-8-prop-2-enyl-chromene-3-carboxylate
The XLogP value of 3.8785 indicates that Benzyl 2-oxo-8-prop-2-enyl-chromene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.51 Ų, Benzyl 2-oxo-8-prop-2-enyl-chromene-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzyl 2-oxo-8-prop-2-enyl-chromene-3-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 Benzyl 2-oxo-8-prop-2-enyl-chromene-3-carboxylate?
The CAS number of Benzyl 2-oxo-8-prop-2-enyl-chromene-3-carboxylate is 5532-49-0.
What is the molecular formula of Benzyl 2-oxo-8-prop-2-enyl-chromene-3-carboxylate?
The molecular formula of Benzyl 2-oxo-8-prop-2-enyl-chromene-3-carboxylate is C20H16O4.
What is the molecular weight of Benzyl 2-oxo-8-prop-2-enyl-chromene-3-carboxylate?
The molecular weight of Benzyl 2-oxo-8-prop-2-enyl-chromene-3-carboxylate is 320.10 g/mol.
Where can I buy Benzyl 2-oxo-8-prop-2-enyl-chromene-3-carboxylate?
You can request a quote for Benzyl 2-oxo-8-prop-2-enyl-chromene-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl 2-oxo-8-prop-2-enyl-chromene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Benzyl 2-oxo-8-prop-2-enyl-chromene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.