EINECS 245-436-4
TL;DR: EINECS 245-436-4 (CAS 23119-03-1) is a chemical compound with molecular formula C38H66N2O2 and molecular weight 582.51245 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,4-dihexyl-5-(10-isocyanatodec-1-enyl)-6-(8-isocyanatooctyl)cyclohexene
Also Known As: Diisocyanic acid, diester with 4,5-dihexyl-6-(10-hydroxydec-1-enyl)cyclohex-2-ene-1-octanol, 3,4-dihexyl-5-(10-isocyanatodec-1-enyl)-6-(8-isocyanatooctyl)cyclohexene, 3,4-DIHEXYL-5-(10-ISOCYANATODEC-1-EN-1-YL)-6-(8-ISOCYANATOOCTYL)CYCLOHEX-1-ENE, EINECS 245-436-4
Technical Specifications
| Molecular Formula | C38H66N2O2 |
| Molecular Weight | 582.51245 g/mol |
| XLogP | 16.6 |
| Topological Polar Surface Area (TPSA) | 58.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 29 |
| Exact Mass | 582.51245 Da |
| Heavy Atoms | 42 |
| Complexity | 763.0 |
| SMILES | CCCCCCC1C=CC(C(C1CCCCCC)C=CCCCCCCCCN=C=O)CCCCCCCCN=C=O |
| InChIKey | NCFRKFKOROVDAZ-UHFFFAOYSA-N |
Chemical Property Profile of EINECS 245-436-4
Property Insights of EINECS 245-436-4
The XLogP value of 16.6 indicates that EINECS 245-436-4 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.9 Ų, EINECS 245-436-4 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, EINECS 245-436-4 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of EINECS 245-436-4?
The CAS number of EINECS 245-436-4 is 23119-03-1.
What is the molecular formula of EINECS 245-436-4?
The molecular formula of EINECS 245-436-4 is C38H66N2O2.
What is the molecular weight of EINECS 245-436-4?
The molecular weight of EINECS 245-436-4 is 582.51245 g/mol.
Where can I buy EINECS 245-436-4?
You can request a quote for EINECS 245-436-4 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for EINECS 245-436-4?
Yes, CoreyChem provides custom synthesis services for EINECS 245-436-4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.