3,4-Dihydro-3,3-dimethyl-2H-naphtho(2,3-b)pyran-5,10-dione
TL;DR: 3,4-Dihydro-3,3-dimethyl-2H-naphtho(2,3-b)pyran-5,10-dione (CAS 138779-63-2) is a chemical compound with molecular formula C15H14O3 and molecular weight 242.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-dimethyl-2,4-dihydrobenzo[g]chromene-5,10-dione
Also Known As: Naphthopyran der., NCI60_021615, 3,3-dimethyl-2,4-dihydrobenzo[g]chromene-5,10-dione, 3,4-Dihydro-3,3-dimethyl-2H-naphtho(2,3-b)pyran-5,10-dione, 3,4-dihydro-3,3-dimethyl-2H-naphtho[2,3-b]pyran-5,10-dione
| Molecular Formula | C15H14O3 |
|---|---|
| Molecular Weight | 242.09 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 | 242.0943 |
| Heavy Atoms | 18 |
| Complexity | 445.0 |
Chemical Identifiers
| CAS Number | 138779-63-2 |
|---|---|
| SMILES | CC1(CC2=C(C(=O)C3=CC=CC=C3C2=O)OC1)C |
| InChIKey | ULXYWPKYMYLJBG-UHFFFAOYSA-N |
Product Overview
3,4-Dihydro-3,3-dimethyl-2H-naphtho(2,3-b)pyran-5,10-dione (CAS 138779-63-2), with molecular formula C15H14O3 and molecular weight 242.09 g/mol. IUPAC: 3,3-dimethyl-2,4-dihydrobenzo[g]chromene-5,10-dione.
Chemical Property Profile of 3,4-Dihydro-3,3-dimethyl-2H-naphtho(2,3-b)pyran-5,10-dione
Property Insights of 3,4-Dihydro-3,3-dimethyl-2H-naphtho(2,3-b)pyran-5,10-dione
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-Dihydro-3,3-dimethyl-2H-naphtho(2,3-b)pyran-5,10-dione. With a topological polar surface area (TPSA) of 43.4 Ų, 3,4-Dihydro-3,3-dimethyl-2H-naphtho(2,3-b)pyran-5,10-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Dihydro-3,3-dimethyl-2H-naphtho(2,3-b)pyran-5,10-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 3,4-Dihydro-3,3-dimethyl-2H-naphtho(2,3-b)pyran-5,10-dione?
The CAS number of 3,4-Dihydro-3,3-dimethyl-2H-naphtho(2,3-b)pyran-5,10-dione is 138779-63-2.
What is the molecular formula of 3,4-Dihydro-3,3-dimethyl-2H-naphtho(2,3-b)pyran-5,10-dione?
The molecular formula of 3,4-Dihydro-3,3-dimethyl-2H-naphtho(2,3-b)pyran-5,10-dione is C15H14O3.
What is the molecular weight of 3,4-Dihydro-3,3-dimethyl-2H-naphtho(2,3-b)pyran-5,10-dione?
The molecular weight of 3,4-Dihydro-3,3-dimethyl-2H-naphtho(2,3-b)pyran-5,10-dione is 242.09 g/mol.
Where can I buy 3,4-Dihydro-3,3-dimethyl-2H-naphtho(2,3-b)pyran-5,10-dione?
You can request a quote for 3,4-Dihydro-3,3-dimethyl-2H-naphtho(2,3-b)pyran-5,10-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Dihydro-3,3-dimethyl-2H-naphtho(2,3-b)pyran-5,10-dione?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Dihydro-3,3-dimethyl-2H-naphtho(2,3-b)pyran-5,10-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.