Nemotin
TL;DR: Nemotin (CAS 502-12-5) is a chemical compound with molecular formula C11H8O2 and molecular weight 172.05243 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-hepta-1,2-dien-4,6-diynyloxolan-2-one
Also Known As: Nemotin, 5-(1,2-Heptadiene-4,6-diynyl)dihydro-2(3H)-furanone, 5-hepta-1,2-dien-4,6-diynyloxolan-2-one, Undeca-5,6-diene-8,10-diyn-4-olide, 4-17-00-05182 (Beilstein Handbook Reference)
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C11H8O2 |
| Molecular Weight | 172.05243 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 172.05243 Da |
| Heavy Atoms | 13 |
| Complexity | 374.0 |
| SMILES | C#CC#CC=C=CC1CCC(=O)O1 |
| InChIKey | FRTIRZDYHKNXHV-UHFFFAOYSA-N |
Product Description
Applications: Nemotin is used in complex organic molecule assembly across discovery and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Nemotin (CAS 502-12-5) is a organic building block with the molecular formula C11H8O2 and a molecular weight of 172.05 g/mol. Synonyms include Nemotin and 5-(1,2-Heptadiene-4,6-diynyl)dihydro-2(3H)-furanone.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Nemotin
Property Insights of Nemotin
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Nemotin. With a topological polar surface area (TPSA) of 26.3 Ų, Nemotin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Nemotin has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Nemotin?
The CAS number of Nemotin is 502-12-5.
What is the molecular formula of Nemotin?
The molecular formula of Nemotin is C11H8O2.
What is the molecular weight of Nemotin?
The molecular weight of Nemotin is 172.05243 g/mol.
What are the applications of Nemotin?
Nemotin is used in complex organic molecule assembly across discovery and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation...
Where can I buy Nemotin?
You can request a quote for Nemotin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Nemotin?
Yes, CoreyChem provides custom synthesis services for Nemotin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.