Benzoic acid, 4-(allyloxy)-3,5-diallyl-
TL;DR: Benzoic acid, 4-(allyloxy)-3,5-diallyl- (CAS 100347-69-1) is a chemical compound with molecular formula C16H18O3 and molecular weight 258.12558 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-prop-2-enoxy-3,5-bis(prop-2-enyl)benzoic acid
Also Known As: 4-Allyloxy-3,5-diallylbenzoic acid, BENZOIC ACID, 4-(ALLYLOXY)-3,5-DIALLYL-, 4-(Allyloxy)-3,5-diallylbenzoic acid, 4-prop-2-enoxy-3,5-bis(prop-2-enyl)benzoic acid, 3,5-di(prop-2-en-1-yl)-4-(prop-2-en-1-yloxy)benzoic acid
Technical Specifications
| Molecular Formula | C16H18O3 |
| Molecular Weight | 258.12558 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 258.12558 Da |
| Heavy Atoms | 19 |
| Complexity | 315.0 |
| SMILES | C=CCC1=CC(=CC(=C1OCC=C)CC=C)C(=O)O |
| InChIKey | AFOPLOLSLKSEAK-UHFFFAOYSA-N |
Chemical Property Profile of Benzoic acid, 4-(allyloxy)-3,5-diallyl-
Property Insights of Benzoic acid, 4-(allyloxy)-3,5-diallyl-
The XLogP value of 4.2 indicates that Benzoic acid, 4-(allyloxy)-3,5-diallyl- 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-(allyloxy)-3,5-diallyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoic acid, 4-(allyloxy)-3,5-diallyl- has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Benzoic acid, 4-(allyloxy)-3,5-diallyl-?
The CAS number of Benzoic acid, 4-(allyloxy)-3,5-diallyl- is 100347-69-1.
What is the molecular formula of Benzoic acid, 4-(allyloxy)-3,5-diallyl-?
The molecular formula of Benzoic acid, 4-(allyloxy)-3,5-diallyl- is C16H18O3.
What is the molecular weight of Benzoic acid, 4-(allyloxy)-3,5-diallyl-?
The molecular weight of Benzoic acid, 4-(allyloxy)-3,5-diallyl- is 258.12558 g/mol.
Where can I buy Benzoic acid, 4-(allyloxy)-3,5-diallyl-?
You can request a quote for Benzoic acid, 4-(allyloxy)-3,5-diallyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzoic acid, 4-(allyloxy)-3,5-diallyl-?
Yes, CoreyChem provides custom synthesis services for Benzoic acid, 4-(allyloxy)-3,5-diallyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.