Norcocaethylene
TL;DR: Norcocaethylene (CAS 137220-02-1) is a chemical compound with molecular formula C17H21NO4 and molecular weight 303.14706 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl (1R,2R,3S,5S)-3-benzoyloxy-8-azabicyclo[3.2.1]octane-2-carboxylate
Also Known As: Norcocaethylene, Norcocaethyline, Norethylcocaine, Norhomocoaine, N-Demethylcocaehylene
Technical Specifications
| Molecular Formula | C17H21NO4 |
| Molecular Weight | 303.14706 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 64.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 303.14706 Da |
| Heavy Atoms | 22 |
| Complexity | 419.0 |
| SMILES | CCOC(=O)[C@@H]1[C@H]2CC[C@H](N2)C[C@@H]1OC(=O)C3=CC=CC=C3 |
| InChIKey | MABVIZVTLRQVOB-LJISPDSOSA-N |
Chemical Property Profile of Norcocaethylene
Property Insights of Norcocaethylene
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Norcocaethylene. The TPSA of 64.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Norcocaethylene. Following Lipinski's Rule of Five, Norcocaethylene has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Norcocaethylene?
The CAS number of Norcocaethylene is 137220-02-1.
What is the molecular formula of Norcocaethylene?
The molecular formula of Norcocaethylene is C17H21NO4.
What is the molecular weight of Norcocaethylene?
The molecular weight of Norcocaethylene is 303.14706 g/mol.
Where can I buy Norcocaethylene?
You can request a quote for Norcocaethylene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Norcocaethylene?
Yes, CoreyChem provides custom synthesis services for Norcocaethylene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.