N-2-Ethylhexylbicycloheptenedicarboximide
TL;DR: N-2-Ethylhexylbicycloheptenedicarboximide (CAS 113-48-4) is a chemical compound with molecular formula C17H25NO2 and molecular weight 275.18854 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(2-ethylhexyl)-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
Also Known As: Pyrodone, zengxiaoan, Synergist 264, Pyrdone (obsolete), Sinepyrin 222
Application Areas
Top 5 of 10 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C17H25NO2 |
| Molecular Weight | 275.18854 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 37.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 275.18854 Da |
| Heavy Atoms | 20 |
| Complexity | 412.0 |
| SMILES | CCCCC(CC)CN1C(=O)C2C3CC(C2C1=O)C=C3 |
| InChIKey | WLLGXSLBOPFWQV-UHFFFAOYSA-N |
Product Description
Applications: N-2-Ethylhexylbicycloheptenedicarboximide is used in agrochemical development, including crop protection agent synthesis, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. 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).
N-2-Ethylhexylbicycloheptenedicarboximide is a agrochemical intermediate identified by CAS number 113-48-4 and the molecular formula C17H25NO2 and a molecular weight of 275.19 g/mol. Synonyms include Pyrodone and zengxiaoan.
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 N-2-Ethylhexylbicycloheptenedicarboximide
Property Insights of N-2-Ethylhexylbicycloheptenedicarboximide
The XLogP value of 3.4 indicates that N-2-Ethylhexylbicycloheptenedicarboximide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.4 Ų, N-2-Ethylhexylbicycloheptenedicarboximide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-2-Ethylhexylbicycloheptenedicarboximide 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 N-2-Ethylhexylbicycloheptenedicarboximide?
The CAS number of N-2-Ethylhexylbicycloheptenedicarboximide is 113-48-4.
What is the molecular formula of N-2-Ethylhexylbicycloheptenedicarboximide?
The molecular formula of N-2-Ethylhexylbicycloheptenedicarboximide is C17H25NO2.
What is the molecular weight of N-2-Ethylhexylbicycloheptenedicarboximide?
The molecular weight of N-2-Ethylhexylbicycloheptenedicarboximide is 275.18854 g/mol.
What are the applications of N-2-Ethylhexylbicycloheptenedicarboximide?
N-2-Ethylhexylbicycloheptenedicarboximide is used in agrochemical development, including crop protection agent synthesis, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from...
Where can I buy N-2-Ethylhexylbicycloheptenedicarboximide?
You can request a quote for N-2-Ethylhexylbicycloheptenedicarboximide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-2-Ethylhexylbicycloheptenedicarboximide?
Yes, CoreyChem provides custom synthesis services for N-2-Ethylhexylbicycloheptenedicarboximide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.