2-acetyl-3H-benzo(f)chromen-3-one
TL;DR: 2-acetyl-3H-benzo(f)chromen-3-one (CAS 727-80-0) is a chemical compound with molecular formula C15H10O3 and molecular weight 238.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-acetylbenzo[f]chromen-3-one
Also Known As: 2-acetyl-3H-benzo[f]chromen-3-one, 3-Acetylbenzo[f]coumarin, 2-acetylbenzo[f]chromen-3-one, 2-Acetyl-benzo[f]chromen-3-one, 2-acetyl-3-oxobenzo[f]chromene
| Molecular Formula | C15H10O3 |
|---|---|
| Molecular Weight | 238.06 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 238.06299 |
| Heavy Atoms | 18 |
| Complexity | 410.0 |
Chemical Identifiers
| CAS Number | 727-80-0 |
|---|---|
| SMILES | CC(=O)C1=CC2=C(C=CC3=CC=CC=C32)OC1=O |
| InChIKey | UAMPJVJAALGMNG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-acetyl-3H-benzo(f)chromen-3-one (CAS 727-80-0), with molecular formula C15H10O3 and molecular weight 238.06 g/mol. IUPAC: 2-acetylbenzo[f]chromen-3-one.
Chemical Property Profile of 2-acetyl-3H-benzo(f)chromen-3-one
Property Insights of 2-acetyl-3H-benzo(f)chromen-3-one
The XLogP value of 3.1 indicates that 2-acetyl-3H-benzo(f)chromen-3-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, 2-acetyl-3H-benzo(f)chromen-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-acetyl-3H-benzo(f)chromen-3-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 2-acetyl-3H-benzo(f)chromen-3-one?
The CAS number of 2-acetyl-3H-benzo(f)chromen-3-one is 727-80-0.
What is the molecular formula of 2-acetyl-3H-benzo(f)chromen-3-one?
The molecular formula of 2-acetyl-3H-benzo(f)chromen-3-one is C15H10O3.
What is the molecular weight of 2-acetyl-3H-benzo(f)chromen-3-one?
The molecular weight of 2-acetyl-3H-benzo(f)chromen-3-one is 238.06 g/mol.
Where can I buy 2-acetyl-3H-benzo(f)chromen-3-one?
You can request a quote for 2-acetyl-3H-benzo(f)chromen-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-acetyl-3H-benzo(f)chromen-3-one?
Yes, KEHONG BIO provides custom synthesis services for 2-acetyl-3H-benzo(f)chromen-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.