5,7-dimethyl-4-oxo-4H-chromene-3-carbaldehyde
TL;DR: 5,7-dimethyl-4-oxo-4H-chromene-3-carbaldehyde (CAS 62484-76-8) is a chemical compound with molecular formula C12H10O3 and molecular weight 202.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,7-dimethyl-4-oxochromene-3-carbaldehyde
Also Known As: 5,7-Dimethyl-4-oxo-4H-chromene-3-carbaldehyde, 5,7-Dimethyl-3-formylchromone, 5,7-Dimethylchromone-3-carboxaldehyde, 5,7-dimethyl-4-oxochromene-3-carbaldehyde, TIMTEC-BB SBB005563
| Molecular Formula | C12H10O3 |
|---|---|
| Molecular Weight | 202.06 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 202.06299 |
| Heavy Atoms | 15 |
| Complexity | 319.0 |
Chemical Identifiers
| CAS Number | 62484-76-8 |
|---|---|
| SMILES | CC1=CC(=C2C(=C1)OC=C(C2=O)C=O)C |
| InChIKey | MVKCOCQJKGTQAM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5,7-dimethyl-4-oxo-4H-chromene-3-carbaldehyde (CAS 62484-76-8), with molecular formula C12H10O3 and molecular weight 202.06 g/mol. IUPAC: 5,7-dimethyl-4-oxochromene-3-carbaldehyde.
Chemical Property Profile of 5,7-dimethyl-4-oxo-4H-chromene-3-carbaldehyde
Property Insights of 5,7-dimethyl-4-oxo-4H-chromene-3-carbaldehyde
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,7-dimethyl-4-oxo-4H-chromene-3-carbaldehyde. With a topological polar surface area (TPSA) of 43.4 Ų, 5,7-dimethyl-4-oxo-4H-chromene-3-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,7-dimethyl-4-oxo-4H-chromene-3-carbaldehyde 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 5,7-dimethyl-4-oxo-4H-chromene-3-carbaldehyde?
The CAS number of 5,7-dimethyl-4-oxo-4H-chromene-3-carbaldehyde is 62484-76-8.
What is the molecular formula of 5,7-dimethyl-4-oxo-4H-chromene-3-carbaldehyde?
The molecular formula of 5,7-dimethyl-4-oxo-4H-chromene-3-carbaldehyde is C12H10O3.
What is the molecular weight of 5,7-dimethyl-4-oxo-4H-chromene-3-carbaldehyde?
The molecular weight of 5,7-dimethyl-4-oxo-4H-chromene-3-carbaldehyde is 202.06 g/mol.
Where can I buy 5,7-dimethyl-4-oxo-4H-chromene-3-carbaldehyde?
You can request a quote for 5,7-dimethyl-4-oxo-4H-chromene-3-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,7-dimethyl-4-oxo-4H-chromene-3-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 5,7-dimethyl-4-oxo-4H-chromene-3-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.