Ammonium 2,6,6-trimethyltetrahydro-2H-pyran-2-carboxylate
TL;DR: Ammonium 2,6,6-trimethyltetrahydro-2H-pyran-2-carboxylate (CAS 1029874-56-3) is a chemical compound with molecular formula C9H19NO3 and molecular weight 189.13649 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
azanium 2,6,6-trimethyloxane-2-carboxylate
Also Known As: Azanium 2,6,6-trimethyloxane-2-carboxylate, Ammonium 2,6,6-trimethyltetrahydro-2H-pyran-2-carboxylate
Technical Specifications
| Molecular Formula | C9H19NO3 |
| Molecular Weight | 189.13649 g/mol |
| XLogP | 0.8503 |
| Topological Polar Surface Area (TPSA) | 50.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 189.13649 Da |
| Heavy Atoms | 13 |
| Complexity | 192.0 |
| SMILES | CC1(CCCC(O1)(C)C(=O)[O-])C.[NH4+] |
| InChIKey | RDWVDSLKCOMNGC-UHFFFAOYSA-N |
Chemical Property Profile of Ammonium 2,6,6-trimethyltetrahydro-2H-pyran-2-carboxylate
Property Insights of Ammonium 2,6,6-trimethyltetrahydro-2H-pyran-2-carboxylate
The XLogP value of 0.8503 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ammonium 2,6,6-trimethyltetrahydro-2H-pyran-2-carboxylate. With a topological polar surface area (TPSA) of 50.4 Ų, Ammonium 2,6,6-trimethyltetrahydro-2H-pyran-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium 2,6,6-trimethyltetrahydro-2H-pyran-2-carboxylate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Ammonium 2,6,6-trimethyltetrahydro-2H-pyran-2-carboxylate?
The CAS number of Ammonium 2,6,6-trimethyltetrahydro-2H-pyran-2-carboxylate is 1029874-56-3.
What is the molecular formula of Ammonium 2,6,6-trimethyltetrahydro-2H-pyran-2-carboxylate?
The molecular formula of Ammonium 2,6,6-trimethyltetrahydro-2H-pyran-2-carboxylate is C9H19NO3.
What is the molecular weight of Ammonium 2,6,6-trimethyltetrahydro-2H-pyran-2-carboxylate?
The molecular weight of Ammonium 2,6,6-trimethyltetrahydro-2H-pyran-2-carboxylate is 189.13649 g/mol.
Where can I buy Ammonium 2,6,6-trimethyltetrahydro-2H-pyran-2-carboxylate?
You can request a quote for Ammonium 2,6,6-trimethyltetrahydro-2H-pyran-2-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ammonium 2,6,6-trimethyltetrahydro-2H-pyran-2-carboxylate?
Yes, CoreyChem provides custom synthesis services for Ammonium 2,6,6-trimethyltetrahydro-2H-pyran-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.