TL;DR: Benzene, 1-dodecyl-4-methyl- (CAS 104-41-6) is a chemical compound with molecular formula C19H32 and molecular weight 260.2504 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-dodecyl-4-methylbenzene
Also Known As: p-Dodecyltoluene, 1-dodecyl-4-methylbenzene, p-dodecyltoluen, 4-Dodecyltoluene, Benzene, 1-dodecyl-4-methyl-
Top 5 of 13 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C19H32 |
| Molecular Weight | 260.2504 g/mol |
| XLogP | 9.1 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 11 |
| Exact Mass | 260.2504 Da |
| Heavy Atoms | 19 |
| Complexity | 176.0 |
| SMILES | CCCCCCCCCCCCC1=CC=C(C=C1)C |
| InChIKey | BOSMBEZWDZNQJQ-UHFFFAOYSA-N |
The XLogP value of 9.1 indicates that Benzene, 1-dodecyl-4-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Benzene, 1-dodecyl-4-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, 1-dodecyl-4-methyl- has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Benzene, 1-dodecyl-4-methyl- is 104-41-6.
The molecular formula of Benzene, 1-dodecyl-4-methyl- is C19H32.
The molecular weight of Benzene, 1-dodecyl-4-methyl- is 260.2504 g/mol.
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