3,6-Dimethoxy-2-methyloxan-4-one
TL;DR: 3,6-Dimethoxy-2-methyloxan-4-one (CAS 61199-77-7) is a chemical compound with molecular formula C8H14O4 and molecular weight 174.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,6-dimethoxy-2-methyloxan-4-one
Also Known As: 3,6-dimethoxy-2-methyloxan-4-one, 3,6-dimethoxy-2-methyl-oxan-4-one, Methyl 2,6-dideoxy-4-O-methylhexopyranosid-3-ulose
| Molecular Formula | C8H14O4 |
|---|---|
| Molecular Weight | 174.09 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 174.0892 |
| Heavy Atoms | 12 |
| Complexity | 168.0 |
Chemical Identifiers
| CAS Number | 61199-77-7 |
|---|---|
| SMILES | CC1C(C(=O)CC(O1)OC)OC |
| InChIKey | KOQNSXZGLJKKNF-UHFFFAOYSA-N |
Product Overview
3,6-Dimethoxy-2-methyloxan-4-one (CAS 61199-77-7), with molecular formula C8H14O4 and molecular weight 174.09 g/mol. IUPAC: 3,6-dimethoxy-2-methyloxan-4-one.
Chemical Property Profile of 3,6-Dimethoxy-2-methyloxan-4-one
Property Insights of 3,6-Dimethoxy-2-methyloxan-4-one
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,6-Dimethoxy-2-methyloxan-4-one. With a topological polar surface area (TPSA) of 44.8 Ų, 3,6-Dimethoxy-2-methyloxan-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,6-Dimethoxy-2-methyloxan-4-one has 0 hydrogen bond donor(s) and 4 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 3,6-Dimethoxy-2-methyloxan-4-one?
The CAS number of 3,6-Dimethoxy-2-methyloxan-4-one is 61199-77-7.
What is the molecular formula of 3,6-Dimethoxy-2-methyloxan-4-one?
The molecular formula of 3,6-Dimethoxy-2-methyloxan-4-one is C8H14O4.
What is the molecular weight of 3,6-Dimethoxy-2-methyloxan-4-one?
The molecular weight of 3,6-Dimethoxy-2-methyloxan-4-one is 174.09 g/mol.
Where can I buy 3,6-Dimethoxy-2-methyloxan-4-one?
You can request a quote for 3,6-Dimethoxy-2-methyloxan-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,6-Dimethoxy-2-methyloxan-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3,6-Dimethoxy-2-methyloxan-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.