Benzoic acid, 4-methyl-, 4-(1-oxo-3-phenyl-2-propenyl)phenyl ester
TL;DR: Benzoic acid, 4-methyl-, 4-(1-oxo-3-phenyl-2-propenyl)phenyl ester (CAS 111819-11-5) is a chemical compound with molecular formula C23H18O3 and molecular weight 342.12558 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-(3-phenylprop-2-enoyl)phenyl] 4-methylbenzoate
Also Known As: [4-(3-phenylprop-2-enoyl)phenyl] 4-methylbenzoate, Benzoic acid, 4-methyl-, 4-(1-oxo-3-phenyl-2-propenyl)phenyl ester, 4-(3-PHENYLPROP-2-ENOYL)PHENYL 4-METHYLBENZOATE, Benzoic acid,4-methyl-,4-(1-oxo-3-phenyl-2-propenyl)phenyl ester
Technical Specifications
| Molecular Formula | C23H18O3 |
| Molecular Weight | 342.12558 g/mol |
| XLogP | 5.5 |
| Topological Polar Surface Area (TPSA) | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 342.12558 Da |
| Heavy Atoms | 26 |
| Complexity | 488.0 |
| SMILES | CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)C=CC3=CC=CC=C3 |
| InChIKey | SRHMBBGOCZJYAJ-UHFFFAOYSA-N |
Chemical Property Profile of Benzoic acid, 4-methyl-, 4-(1-oxo-3-phenyl-2-propenyl)phenyl ester
Property Insights of Benzoic acid, 4-methyl-, 4-(1-oxo-3-phenyl-2-propenyl)phenyl ester
The XLogP value of 5.5 indicates that Benzoic acid, 4-methyl-, 4-(1-oxo-3-phenyl-2-propenyl)phenyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.4 Ų, Benzoic acid, 4-methyl-, 4-(1-oxo-3-phenyl-2-propenyl)phenyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoic acid, 4-methyl-, 4-(1-oxo-3-phenyl-2-propenyl)phenyl 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-methyl-, 4-(1-oxo-3-phenyl-2-propenyl)phenyl ester?
The CAS number of Benzoic acid, 4-methyl-, 4-(1-oxo-3-phenyl-2-propenyl)phenyl ester is 111819-11-5.
What is the molecular formula of Benzoic acid, 4-methyl-, 4-(1-oxo-3-phenyl-2-propenyl)phenyl ester?
The molecular formula of Benzoic acid, 4-methyl-, 4-(1-oxo-3-phenyl-2-propenyl)phenyl ester is C23H18O3.
What is the molecular weight of Benzoic acid, 4-methyl-, 4-(1-oxo-3-phenyl-2-propenyl)phenyl ester?
The molecular weight of Benzoic acid, 4-methyl-, 4-(1-oxo-3-phenyl-2-propenyl)phenyl ester is 342.12558 g/mol.
Where can I buy Benzoic acid, 4-methyl-, 4-(1-oxo-3-phenyl-2-propenyl)phenyl ester?
You can request a quote for Benzoic acid, 4-methyl-, 4-(1-oxo-3-phenyl-2-propenyl)phenyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzoic acid, 4-methyl-, 4-(1-oxo-3-phenyl-2-propenyl)phenyl ester?
Yes, CoreyChem provides custom synthesis services for Benzoic acid, 4-methyl-, 4-(1-oxo-3-phenyl-2-propenyl)phenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.