3-Benzoyl-4H-1-benzopyran-4-one
TL;DR: 3-Benzoyl-4H-1-benzopyran-4-one (CAS 4197-99-3) is a chemical compound with molecular formula C16H10O3 and molecular weight 250.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzoylchromen-4-one
Also Known As: 3-Benzoylchromon, 3-Benzoylchromone, 3-benzoylchromen-4-one, 3-Benzoyl-4H-1-benzopyran-4-one, 3-benzoyl-4H-chromen-4-one
| Molecular Formula | C16H10O3 |
|---|---|
| Molecular Weight | 250.06 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 250.06299 |
| Heavy Atoms | 19 |
| Complexity | 404.0 |
Chemical Identifiers
| CAS Number | 4197-99-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C2=COC3=CC=CC=C3C2=O |
| InChIKey | IEBRORAPSVJFPR-UHFFFAOYSA-N |
Product Overview
3-Benzoyl-4H-1-benzopyran-4-one (CAS 4197-99-3), with molecular formula C16H10O3 and molecular weight 250.06 g/mol. IUPAC: 3-benzoylchromen-4-one.
Chemical Property Profile of 3-Benzoyl-4H-1-benzopyran-4-one
Property Insights of 3-Benzoyl-4H-1-benzopyran-4-one
The XLogP value of 3.1 indicates that 3-Benzoyl-4H-1-benzopyran-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.4 Ų, 3-Benzoyl-4H-1-benzopyran-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Benzoyl-4H-1-benzopyran-4-one has 0 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 3-Benzoyl-4H-1-benzopyran-4-one?
The CAS number of 3-Benzoyl-4H-1-benzopyran-4-one is 4197-99-3.
What is the molecular formula of 3-Benzoyl-4H-1-benzopyran-4-one?
The molecular formula of 3-Benzoyl-4H-1-benzopyran-4-one is C16H10O3.
What is the molecular weight of 3-Benzoyl-4H-1-benzopyran-4-one?
The molecular weight of 3-Benzoyl-4H-1-benzopyran-4-one is 250.06 g/mol.
Where can I buy 3-Benzoyl-4H-1-benzopyran-4-one?
You can request a quote for 3-Benzoyl-4H-1-benzopyran-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Benzoyl-4H-1-benzopyran-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Benzoyl-4H-1-benzopyran-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.