2,4-dimethylphenyl 2-oxo-2H-chromene-3-carboxylate
TL;DR: 2,4-dimethylphenyl 2-oxo-2H-chromene-3-carboxylate (CAS 836662-51-2) is a chemical compound with molecular formula C18H14O4 and molecular weight 294.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,4-dimethylphenyl) 2-oxochromene-3-carboxylate
Also Known As: 2,4-dimethylphenyl 2-oxo-2H-chromene-3-carboxylate, 2,4-dimethylphenyl 2-oxochromene-3-carboxylate, (2,4-dimethylphenyl) 2-oxochromene-3-carboxylate
| Molecular Formula | C18H14O4 |
|---|---|
| Molecular Weight | 294.09 g/mol |
| LogP | 3.62904 |
| Topological Polar Surface Area | 56.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 294.0892 |
| Heavy Atoms | 22 |
| Complexity | 921.7636 |
Chemical Identifiers
| CAS Number | 836662-51-2 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)OC(=O)C2=CC3=CC=CC=C3OC2=O)C |
Product Overview
2,4-dimethylphenyl 2-oxo-2H-chromene-3-carboxylate (CAS 836662-51-2), with molecular formula C18H14O4 and molecular weight 294.09 g/mol. IUPAC: (2,4-dimethylphenyl) 2-oxochromene-3-carboxylate.
Chemical Property Profile of 2,4-dimethylphenyl 2-oxo-2H-chromene-3-carboxylate
Property Insights of 2,4-dimethylphenyl 2-oxo-2H-chromene-3-carboxylate
The XLogP value of 3.62904 indicates that 2,4-dimethylphenyl 2-oxo-2H-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, 2,4-dimethylphenyl 2-oxo-2H-chromene-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-dimethylphenyl 2-oxo-2H-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 2,4-dimethylphenyl 2-oxo-2H-chromene-3-carboxylate?
The CAS number of 2,4-dimethylphenyl 2-oxo-2H-chromene-3-carboxylate is 836662-51-2.
What is the molecular formula of 2,4-dimethylphenyl 2-oxo-2H-chromene-3-carboxylate?
The molecular formula of 2,4-dimethylphenyl 2-oxo-2H-chromene-3-carboxylate is C18H14O4.
What is the molecular weight of 2,4-dimethylphenyl 2-oxo-2H-chromene-3-carboxylate?
The molecular weight of 2,4-dimethylphenyl 2-oxo-2H-chromene-3-carboxylate is 294.09 g/mol.
Where can I buy 2,4-dimethylphenyl 2-oxo-2H-chromene-3-carboxylate?
You can request a quote for 2,4-dimethylphenyl 2-oxo-2H-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 2,4-dimethylphenyl 2-oxo-2H-chromene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 2,4-dimethylphenyl 2-oxo-2H-chromene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.