Benzoic acid, 4-(allyloxy)-3,5-dipropyl-, methyl ester
TL;DR: Benzoic acid, 4-(allyloxy)-3,5-dipropyl-, methyl ester (CAS 100347-78-2) is a chemical compound with molecular formula C17H24O3 and molecular weight 276.17255 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 4-prop-2-enoxy-3,5-dipropylbenzoate
Also Known As: methyl 4-prop-2-enoxy-3,5-dipropylbenzoate, Methyl 4-allyloxy-3,5-dipropylbenzoate, BENZOIC ACID, 4-(ALLYLOXY)-3,5-DIPROPYL-, METHYL ESTER, 4-Allyloxy-3,5-dipropylbenzoic acid methyl ester, methyl 4-(prop-2-en-1-yloxy)-3,5-dipropylbenzoate
Technical Specifications
| Molecular Formula | C17H24O3 |
| Molecular Weight | 276.17255 g/mol |
| XLogP | 5.1 |
| Topological Polar Surface Area (TPSA) | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 276.17255 Da |
| Heavy Atoms | 20 |
| Complexity | 285.0 |
| SMILES | CCCC1=CC(=CC(=C1OCC=C)CCC)C(=O)OC |
| InChIKey | YAFZWNCGWWHTGS-UHFFFAOYSA-N |
Chemical Property Profile of Benzoic acid, 4-(allyloxy)-3,5-dipropyl-, methyl ester
Property Insights of Benzoic acid, 4-(allyloxy)-3,5-dipropyl-, methyl ester
The XLogP value of 5.1 indicates that Benzoic acid, 4-(allyloxy)-3,5-dipropyl-, methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, Benzoic acid, 4-(allyloxy)-3,5-dipropyl-, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoic acid, 4-(allyloxy)-3,5-dipropyl-, methyl ester has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Benzoic acid, 4-(allyloxy)-3,5-dipropyl-, methyl ester?
The CAS number of Benzoic acid, 4-(allyloxy)-3,5-dipropyl-, methyl ester is 100347-78-2.
What is the molecular formula of Benzoic acid, 4-(allyloxy)-3,5-dipropyl-, methyl ester?
The molecular formula of Benzoic acid, 4-(allyloxy)-3,5-dipropyl-, methyl ester is C17H24O3.
What is the molecular weight of Benzoic acid, 4-(allyloxy)-3,5-dipropyl-, methyl ester?
The molecular weight of Benzoic acid, 4-(allyloxy)-3,5-dipropyl-, methyl ester is 276.17255 g/mol.
Where can I buy Benzoic acid, 4-(allyloxy)-3,5-dipropyl-, methyl ester?
You can request a quote for Benzoic acid, 4-(allyloxy)-3,5-dipropyl-, methyl ester 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-dipropyl-, methyl ester?
Yes, CoreyChem provides custom synthesis services for Benzoic acid, 4-(allyloxy)-3,5-dipropyl-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.