2-(Dimethylamino)-3-hydroxy-6-methylpyran-4-one
TL;DR: 2-(Dimethylamino)-3-hydroxy-6-methylpyran-4-one (CAS 39561-51-8) is a chemical compound with molecular formula C8H11NO3 and molecular weight 169.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(dimethylamino)-3-hydroxy-6-methylpyran-4-one
Also Known As: 2-(dimethylamino)-3-hydroxy-6-methylpyran-4-one, 2-(Dimethylamino)-3-hydroxy-6-methyl-4H-pyran-4-one
| Molecular Formula | C8H11NO3 |
|---|---|
| Molecular Weight | 169.07 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 169.0739 |
| Heavy Atoms | 12 |
| Complexity | 276.0 |
Chemical Identifiers
| CAS Number | 39561-51-8 |
|---|---|
| SMILES | CC1=CC(=O)C(=C(O1)N(C)C)O |
| InChIKey | NYRONUWDHYJIKK-UHFFFAOYSA-N |
Product Overview
2-(Dimethylamino)-3-hydroxy-6-methylpyran-4-one (CAS 39561-51-8), with molecular formula C8H11NO3 and molecular weight 169.07 g/mol. IUPAC: 2-(dimethylamino)-3-hydroxy-6-methylpyran-4-one.
Chemical Property Profile of 2-(Dimethylamino)-3-hydroxy-6-methylpyran-4-one
Property Insights of 2-(Dimethylamino)-3-hydroxy-6-methylpyran-4-one
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Dimethylamino)-3-hydroxy-6-methylpyran-4-one. With a topological polar surface area (TPSA) of 49.8 Ų, 2-(Dimethylamino)-3-hydroxy-6-methylpyran-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Dimethylamino)-3-hydroxy-6-methylpyran-4-one has 1 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 2-(Dimethylamino)-3-hydroxy-6-methylpyran-4-one?
The CAS number of 2-(Dimethylamino)-3-hydroxy-6-methylpyran-4-one is 39561-51-8.
What is the molecular formula of 2-(Dimethylamino)-3-hydroxy-6-methylpyran-4-one?
The molecular formula of 2-(Dimethylamino)-3-hydroxy-6-methylpyran-4-one is C8H11NO3.
What is the molecular weight of 2-(Dimethylamino)-3-hydroxy-6-methylpyran-4-one?
The molecular weight of 2-(Dimethylamino)-3-hydroxy-6-methylpyran-4-one is 169.07 g/mol.
Where can I buy 2-(Dimethylamino)-3-hydroxy-6-methylpyran-4-one?
You can request a quote for 2-(Dimethylamino)-3-hydroxy-6-methylpyran-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-(Dimethylamino)-3-hydroxy-6-methylpyran-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(Dimethylamino)-3-hydroxy-6-methylpyran-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.