TL;DR: Nonanedioic acid, 1,9-dinonyl ester (CAS 18803-78-6) is a chemical compound with molecular formula C27H52O4 and molecular weight 440.38657 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dinonyl nonanedioate
Also Known As: Dinonyl nonanedioate, Dinonyl azelate, dinonyl-azelate, Nonanedioic acid, dinonyl ester, Nonanedioic acid, 1,9-dinonyl ester
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C27H52O4 |
| Molecular Weight | 440.38657 g/mol |
| XLogP | 10.1 |
| Topological Polar Surface Area (TPSA) | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 26 |
| Exact Mass | 440.38657 Da |
| Heavy Atoms | 31 |
| Complexity | 359.0 |
| SMILES | CCCCCCCCCOC(=O)CCCCCCCC(=O)OCCCCCCCCC |
| InChIKey | KAKCWCBEABKVPK-UHFFFAOYSA-N |
The XLogP value of 10.1 indicates that Nonanedioic acid, 1,9-dinonyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Nonanedioic acid, 1,9-dinonyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Nonanedioic acid, 1,9-dinonyl ester has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Nonanedioic acid, 1,9-dinonyl ester is 18803-78-6.
The molecular formula of Nonanedioic acid, 1,9-dinonyl ester is C27H52O4.
The molecular weight of Nonanedioic acid, 1,9-dinonyl ester is 440.38657 g/mol.
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