2,5,8-Trimethyl-4H-1-benzopyran-4-one
TL;DR: 2,5,8-Trimethyl-4H-1-benzopyran-4-one (CAS 60595-60-0) is a chemical compound with molecular formula C12H12O2 and molecular weight 188.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5,8-trimethylchromen-4-one
Also Known As: Cromodil, 2,5,8-Trimethylchromone, 2,5,8-Trimethyl-4H-1-benzopyran-4-one, 2,5,8-trimethylchromen-4-one, 2,5,8-trimethyl-chromen-4-one
| Molecular Formula | C12H12O2 |
|---|---|
| Molecular Weight | 188.08 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 188.08372 |
| Heavy Atoms | 14 |
| Complexity | 280.0 |
Chemical Identifiers
| CAS Number | 60595-60-0 |
|---|---|
| SMILES | CC1=C2C(=O)C=C(OC2=C(C=C1)C)C |
| InChIKey | KJRCVOWXLZJQKW-UHFFFAOYSA-N |
Product Overview
2,5,8-Trimethyl-4H-1-benzopyran-4-one (CAS 60595-60-0), with molecular formula C12H12O2 and molecular weight 188.08 g/mol. IUPAC: 2,5,8-trimethylchromen-4-one.
Chemical Property Profile of 2,5,8-Trimethyl-4H-1-benzopyran-4-one
Property Insights of 2,5,8-Trimethyl-4H-1-benzopyran-4-one
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5,8-Trimethyl-4H-1-benzopyran-4-one. With a topological polar surface area (TPSA) of 26.3 Ų, 2,5,8-Trimethyl-4H-1-benzopyran-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5,8-Trimethyl-4H-1-benzopyran-4-one has 0 hydrogen bond donor(s) and 2 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 2,5,8-Trimethyl-4H-1-benzopyran-4-one?
The CAS number of 2,5,8-Trimethyl-4H-1-benzopyran-4-one is 60595-60-0.
What is the molecular formula of 2,5,8-Trimethyl-4H-1-benzopyran-4-one?
The molecular formula of 2,5,8-Trimethyl-4H-1-benzopyran-4-one is C12H12O2.
What is the molecular weight of 2,5,8-Trimethyl-4H-1-benzopyran-4-one?
The molecular weight of 2,5,8-Trimethyl-4H-1-benzopyran-4-one is 188.08 g/mol.
Where can I buy 2,5,8-Trimethyl-4H-1-benzopyran-4-one?
You can request a quote for 2,5,8-Trimethyl-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 2,5,8-Trimethyl-4H-1-benzopyran-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2,5,8-Trimethyl-4H-1-benzopyran-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.