6,7-Dimethyl-4-oxo-4H-chromene-3-carbaldehyde
TL;DR: 6,7-Dimethyl-4-oxo-4H-chromene-3-carbaldehyde (CAS 57803-07-3) 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.
6,7-dimethyl-4-oxochromene-3-carbaldehyde
Also Known As: 6,7-DIMETHYL-4-OXO-4H-CHROMENE-3-CARBALDEHYDE, 6,7-Dimethyl-3-formylchromone, 6,7-dimethyl-4-oxochromene-3-carbaldehyde, 6,7-dimethyl-4-oxo-chromene-3-carbaldehyde, 6,7-Dimethyl-4-oxo-4H-1-benzopyran-3-carbaldehyde
| 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 | 57803-07-3 |
|---|---|
| SMILES | CC1=CC2=C(C=C1C)OC=C(C2=O)C=O |
| InChIKey | XDRXIOAFMFRNOJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6,7-Dimethyl-4-oxo-4H-chromene-3-carbaldehyde (CAS 57803-07-3), with molecular formula C12H10O3 and molecular weight 202.06 g/mol. IUPAC: 6,7-dimethyl-4-oxochromene-3-carbaldehyde.
Chemical Property Profile of 6,7-Dimethyl-4-oxo-4H-chromene-3-carbaldehyde
Property Insights of 6,7-Dimethyl-4-oxo-4H-chromene-3-carbaldehyde
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6,7-Dimethyl-4-oxo-4H-chromene-3-carbaldehyde. With a topological polar surface area (TPSA) of 43.4 Ų, 6,7-Dimethyl-4-oxo-4H-chromene-3-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,7-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 6,7-Dimethyl-4-oxo-4H-chromene-3-carbaldehyde?
The CAS number of 6,7-Dimethyl-4-oxo-4H-chromene-3-carbaldehyde is 57803-07-3.
What is the molecular formula of 6,7-Dimethyl-4-oxo-4H-chromene-3-carbaldehyde?
The molecular formula of 6,7-Dimethyl-4-oxo-4H-chromene-3-carbaldehyde is C12H10O3.
What is the molecular weight of 6,7-Dimethyl-4-oxo-4H-chromene-3-carbaldehyde?
The molecular weight of 6,7-Dimethyl-4-oxo-4H-chromene-3-carbaldehyde is 202.06 g/mol.
Where can I buy 6,7-Dimethyl-4-oxo-4H-chromene-3-carbaldehyde?
You can request a quote for 6,7-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 6,7-Dimethyl-4-oxo-4H-chromene-3-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 6,7-Dimethyl-4-oxo-4H-chromene-3-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.