RefChem:1064536
TL;DR: RefChem:1064536 (CAS 111025-10-6) is a chemical compound with molecular formula C11H17NO3 and molecular weight 211.12085 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl (E)-3-[(2R,5S)-2,5-dimethyl-4-oxopiperidin-1-yl]prop-2-enoate
Also Known As: trans-N-beta-(2e,5e-Dimethyl-4-oxo-1-piperidyl)acrylic acid methyl ester, 2-Propenoic acid, 3-(2,5-dimethyl-4-oxo-1-piperidinyl)-, methyl ester, (1(E),2-alpha,5-beta)-, (1(E),2-alpha,5-beta)-3-(2,5-Dimethyl-4-oxo-1-piperidinyl)-2-propenoic acid methyl ester, methyl (E)-3-[(2R,5S)-2,5-dimethyl-4-oxopiperidin-1-yl]prop-2-enoate
Technical Specifications
| Molecular Formula | C11H17NO3 |
| Molecular Weight | 211.12085 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 46.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 211.12085 Da |
| Heavy Atoms | 15 |
| Complexity | 286.0 |
| SMILES | C[C@@H]1CC(=O)[C@H](CN1/C=C/C(=O)OC)C |
| InChIKey | FTNPWSSFPCXOAS-HYNBTVFTSA-N |
Chemical Property Profile of RefChem:1064536
Property Insights of RefChem:1064536
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1064536. With a topological polar surface area (TPSA) of 46.6 Ų, RefChem:1064536 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1064536 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
What is the CAS number of RefChem:1064536?
The CAS number of RefChem:1064536 is 111025-10-6.
What is the molecular formula of RefChem:1064536?
The molecular formula of RefChem:1064536 is C11H17NO3.
What is the molecular weight of RefChem:1064536?
The molecular weight of RefChem:1064536 is 211.12085 g/mol.
Where can I buy RefChem:1064536?
You can request a quote for RefChem:1064536 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1064536?
Yes, CoreyChem provides custom synthesis services for RefChem:1064536 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.