TL;DR: Benzoic acid, 4-(benzyloxy)-3,5-dipropyl- (CAS 100311-43-1) is a chemical compound with molecular formula C20H24O3 and molecular weight 312.17255 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-phenylmethoxy-3,5-dipropylbenzoic acid
Also Known As: 4-Benzyloxy-3,5-dipropylbenzoic acid, 4-(benzyloxy)-3,5-dipropylbenzoic acid, BENZOIC ACID, 4-(BENZYLOXY)-3,5-DIPROPYL-, 4-phenylmethoxy-3,5-dipropylbenzoic acid, BRN 2597974
| Molecular Formula | C20H24O3 |
| Molecular Weight | 312.17255 g/mol |
| XLogP | 5.6 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 312.17255 Da |
| Heavy Atoms | 23 |
| Complexity | 333.0 |
| SMILES | CCCC1=CC(=CC(=C1OCC2=CC=CC=C2)CCC)C(=O)O |
| InChIKey | DWVYXNYUKKZNIU-UHFFFAOYSA-N |
The XLogP value of 5.6 indicates that Benzoic acid, 4-(benzyloxy)-3,5-dipropyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, Benzoic acid, 4-(benzyloxy)-3,5-dipropyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoic acid, 4-(benzyloxy)-3,5-dipropyl- has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Benzoic acid, 4-(benzyloxy)-3,5-dipropyl- is 100311-43-1.
The molecular formula of Benzoic acid, 4-(benzyloxy)-3,5-dipropyl- is C20H24O3.
The molecular weight of Benzoic acid, 4-(benzyloxy)-3,5-dipropyl- is 312.17255 g/mol.
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