4H,5H-Pyrano[4,3-d]-1,3-dioxin, tetrahydro-8a-methyl-
TL;DR: 4H,5H-Pyrano[4,3-d]-1,3-dioxin, tetrahydro-8a-methyl- (CAS 54340-98-6) is a chemical compound with molecular formula C8H14O3 and molecular weight 158.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8a-methyl-4a,5,7,8-tetrahydro-4H-pyrano[4,3-d][1,3]dioxine
Also Known As: cis-10-methyl-1,3,7-trioxadecalin, 4H,5H-Pyrano[4,3-d]-1,3-dioxin, tetrahydro-8a-methyl-, 8a-methyl-4a,5,7,8-tetrahydro-4H-pyrano[4,3-d][1,3]dioxine, 8a-methyl-hexahydro-2H-pyrano[4,3-d][1,3]dioxine, 8a-Methyltetrahydro-4H,5H-pyrano[4,3-d][1,3]dioxine
| Molecular Formula | C8H14O3 |
|---|---|
| Molecular Weight | 158.09 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 158.0943 |
| Heavy Atoms | 11 |
| Complexity | 148.0 |
Chemical Identifiers
| CAS Number | 54340-98-6 |
|---|---|
| SMILES | CC12CCOCC1COCO2 |
| InChIKey | DJRKTOCOJNLGNB-UHFFFAOYSA-N |
Product Overview
4H,5H-Pyrano[4,3-d]-1,3-dioxin, tetrahydro-8a-methyl- (CAS 54340-98-6), with molecular formula C8H14O3 and molecular weight 158.09 g/mol. IUPAC: 8a-methyl-4a,5,7,8-tetrahydro-4H-pyrano[4,3-d][1,3]dioxine.
Chemical Property Profile of 4H,5H-Pyrano[4,3-d]-1,3-dioxin, tetrahydro-8a-methyl-
Property Insights of 4H,5H-Pyrano[4,3-d]-1,3-dioxin, tetrahydro-8a-methyl-
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4H,5H-Pyrano[4,3-d]-1,3-dioxin, tetrahydro-8a-methyl-. With a topological polar surface area (TPSA) of 27.7 Ų, 4H,5H-Pyrano[4,3-d]-1,3-dioxin, tetrahydro-8a-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4H,5H-Pyrano[4,3-d]-1,3-dioxin, tetrahydro-8a-methyl- 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 4H,5H-Pyrano[4,3-d]-1,3-dioxin, tetrahydro-8a-methyl-?
The CAS number of 4H,5H-Pyrano[4,3-d]-1,3-dioxin, tetrahydro-8a-methyl- is 54340-98-6.
What is the molecular formula of 4H,5H-Pyrano[4,3-d]-1,3-dioxin, tetrahydro-8a-methyl-?
The molecular formula of 4H,5H-Pyrano[4,3-d]-1,3-dioxin, tetrahydro-8a-methyl- is C8H14O3.
What is the molecular weight of 4H,5H-Pyrano[4,3-d]-1,3-dioxin, tetrahydro-8a-methyl-?
The molecular weight of 4H,5H-Pyrano[4,3-d]-1,3-dioxin, tetrahydro-8a-methyl- is 158.09 g/mol.
Where can I buy 4H,5H-Pyrano[4,3-d]-1,3-dioxin, tetrahydro-8a-methyl-?
You can request a quote for 4H,5H-Pyrano[4,3-d]-1,3-dioxin, tetrahydro-8a-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4H,5H-Pyrano[4,3-d]-1,3-dioxin, tetrahydro-8a-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 4H,5H-Pyrano[4,3-d]-1,3-dioxin, tetrahydro-8a-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.