2-(2,6-Dimethylpyran-4-ylidene)indene-1,3-dione
TL;DR: 2-(2,6-Dimethylpyran-4-ylidene)indene-1,3-dione (CAS 71107-31-8) is a chemical compound with molecular formula C16H12O3 and molecular weight 252.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,6-dimethylpyran-4-ylidene)indene-1,3-dione
Also Known As: 2-(2,6-dimethylpyran-4-ylidene)indene-1,3-dione, 2-(2,6-dimethyl-4H-pyran-4-ylidene)-1H-indene-1,3(2H)-dione, J2.715.325I, 2-(2,6-dimethyl-4-pyranylidene)indene-1,3-dione, 2-(2,6-dimethylpyran-4-ylidene)indane-1,3-quinone
| Molecular Formula | C16H12O3 |
|---|---|
| Molecular Weight | 252.08 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 252.07864 |
| Heavy Atoms | 19 |
| Complexity | 502.0 |
Chemical Identifiers
| CAS Number | 71107-31-8 |
|---|---|
| SMILES | CC1=CC(=C2C(=O)C3=CC=CC=C3C2=O)C=C(O1)C |
| InChIKey | DPCHHWLRXZZPAI-UHFFFAOYSA-N |
Product Overview
2-(2,6-Dimethylpyran-4-ylidene)indene-1,3-dione (CAS 71107-31-8), with molecular formula C16H12O3 and molecular weight 252.08 g/mol. IUPAC: 2-(2,6-dimethylpyran-4-ylidene)indene-1,3-dione.
Chemical Property Profile of 2-(2,6-Dimethylpyran-4-ylidene)indene-1,3-dione
Property Insights of 2-(2,6-Dimethylpyran-4-ylidene)indene-1,3-dione
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2,6-Dimethylpyran-4-ylidene)indene-1,3-dione. With a topological polar surface area (TPSA) of 43.4 Ų, 2-(2,6-Dimethylpyran-4-ylidene)indene-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2,6-Dimethylpyran-4-ylidene)indene-1,3-dione 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-(2,6-Dimethylpyran-4-ylidene)indene-1,3-dione?
The CAS number of 2-(2,6-Dimethylpyran-4-ylidene)indene-1,3-dione is 71107-31-8.
What is the molecular formula of 2-(2,6-Dimethylpyran-4-ylidene)indene-1,3-dione?
The molecular formula of 2-(2,6-Dimethylpyran-4-ylidene)indene-1,3-dione is C16H12O3.
What is the molecular weight of 2-(2,6-Dimethylpyran-4-ylidene)indene-1,3-dione?
The molecular weight of 2-(2,6-Dimethylpyran-4-ylidene)indene-1,3-dione is 252.08 g/mol.
Where can I buy 2-(2,6-Dimethylpyran-4-ylidene)indene-1,3-dione?
You can request a quote for 2-(2,6-Dimethylpyran-4-ylidene)indene-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2,6-Dimethylpyran-4-ylidene)indene-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,6-Dimethylpyran-4-ylidene)indene-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.