4-(4-Phenyl-buta-1,3-dienyl)-benzoic acid methyl ester
TL;DR: 4-(4-Phenyl-buta-1,3-dienyl)-benzoic acid methyl ester (CAS 101723-02-8) is a chemical compound with molecular formula C18H16O2 and molecular weight 264.11502 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 4-(4-phenylbuta-1,3-dienyl)benzoate
Also Known As: Methyl 4-(4-phenylbuta-1,3-dienyl)benzoate, 4-(4-phenyl-buta-1,3-dienyl)-benzoic acid methyl ester, METHYL 4-(4-PHENYL-1,3-BUTADIEN-1-YL)BENZOATE
Technical Specifications
| Molecular Formula | C18H16O2 |
| Molecular Weight | 264.11502 g/mol |
| XLogP | 5.2 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 264.11502 Da |
| Heavy Atoms | 20 |
| Complexity | 342.0 |
| SMILES | COC(=O)C1=CC=C(C=C1)C=CC=CC2=CC=CC=C2 |
| InChIKey | JWOHPCKUEACJOY-UHFFFAOYSA-N |
Chemical Property Profile of 4-(4-Phenyl-buta-1,3-dienyl)-benzoic acid methyl ester
Property Insights of 4-(4-Phenyl-buta-1,3-dienyl)-benzoic acid methyl ester
The XLogP value of 5.2 indicates that 4-(4-Phenyl-buta-1,3-dienyl)-benzoic acid methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 4-(4-Phenyl-buta-1,3-dienyl)-benzoic acid methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-Phenyl-buta-1,3-dienyl)-benzoic acid methyl ester has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 4-(4-Phenyl-buta-1,3-dienyl)-benzoic acid methyl ester?
The CAS number of 4-(4-Phenyl-buta-1,3-dienyl)-benzoic acid methyl ester is 101723-02-8.
What is the molecular formula of 4-(4-Phenyl-buta-1,3-dienyl)-benzoic acid methyl ester?
The molecular formula of 4-(4-Phenyl-buta-1,3-dienyl)-benzoic acid methyl ester is C18H16O2.
What is the molecular weight of 4-(4-Phenyl-buta-1,3-dienyl)-benzoic acid methyl ester?
The molecular weight of 4-(4-Phenyl-buta-1,3-dienyl)-benzoic acid methyl ester is 264.11502 g/mol.
Where can I buy 4-(4-Phenyl-buta-1,3-dienyl)-benzoic acid methyl ester?
You can request a quote for 4-(4-Phenyl-buta-1,3-dienyl)-benzoic acid methyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(4-Phenyl-buta-1,3-dienyl)-benzoic acid methyl ester?
Yes, CoreyChem provides custom synthesis services for 4-(4-Phenyl-buta-1,3-dienyl)-benzoic acid methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.